UCT HPC cluster

JOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:47:51 SAST 2025

MaxRAM=7.5G
MaxVMSize=0G
AveCPUFreq=106K
AveDiskRead=7542919707
AveDiskWrite=10103773866

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=10:30:27 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-26T12:17:24 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=gpu:l40s:1(IDX:2)
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:48:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:49:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:49:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:50:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:51:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:51:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:52:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:53:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:53:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:54:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:55:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:55:57 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:56:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:57:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:57:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:58:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:59:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 22:59:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:00:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:01:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:01:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:02:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:03:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:03:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:04:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:05:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:05:57 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:06:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:07:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:07:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:08:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:09:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:09:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:10:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:11:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:11:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:12:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:13:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:13:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:14:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:15:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:15:57 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:16:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:17:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:17:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:18:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:19:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:19:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:20:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:21:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:21:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:22:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:23:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:23:51 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:24:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:25:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:25:57 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:26:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:27:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:27:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:28:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:29:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:29:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:30:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:31:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:31:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:32:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:33:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:33:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:34:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:35:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:35:58 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:36:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:37:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:37:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:38:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:39:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:39:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:40:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:41:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:41:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:42:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:43:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:43:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:44:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:45:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:45:59 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:46:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:47:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:47:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:48:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:49:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:49:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:50:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:51:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:51:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:52:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:53:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:53:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:54:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:55:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:55:59 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:56:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:57:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:57:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:58:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:59:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Mon Aug 25 23:59:52 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:00:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:01:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:01:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:02:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:03:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:03:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:04:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:05:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:05:59 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:06:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:07:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:07:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:08:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:09:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:09:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:10:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:11:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:11:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:12:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:13:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:13:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:14:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:15:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:15:59 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:16:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:17:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:17:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:18:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:19:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:19:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:20:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:21:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:21:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:22:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:23:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:23:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:24:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:25:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:26:00 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:26:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:27:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:27:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:28:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:29:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:29:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:30:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:31:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:31:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:32:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:33:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:33:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:34:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:35:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:36:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:36:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:37:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:37:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:38:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:39:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:39:53 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:40:32 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:41:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:41:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:42:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:43:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:43:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:44:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:45:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:46:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:46:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:47:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:47:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:48:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:49:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:49:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:50:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:51:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:51:55 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:52:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:53:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:53:55 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:54:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:55:02 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:56:00 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:56:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:57:01 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:57:54 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:58:31 SAST 2025

JobId=242799 ArrayJobId=242799 ArrayTaskId=2 JobName=NMR_hypar_finetune
   UserId=dnxmat002(1221905217 Matthew Dean) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7075 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=FAILED Reason=NonZeroExitCode Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=1:0
   DerivedExitCode=0:0
   RunTime=10:30:57 TimeLimit=1-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-25T12:17:23 EligibleTime=2025-08-25T12:17:23
   AccrueTime=Unknown
   StartTime=2025-08-25T12:17:24 EndTime=2025-08-25T22:48:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-25T12:17:24 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:164694
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=4 NumTasks=4 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=4,mem=40000M,node=1,billing=7,gres/gpu=1,gres/gpu:l40s=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:l40s:1
     Nodes=srvrocgpu012 CPU_IDs=4-5,28-29 Mem=40000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/dnxmat002/unimol2/Scripts/combined/combined_hyp.sh
   WorkDir=/home/dnxmat002/unimol2/Scripts/combined
   StdErr=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   StdIn=/dev/null
   StdOut=/home/dnxmat002/unimol2/Scripts/combined/slurm-242799_2.out
   Power=
   TresPerNode=gres/gpu:l40s:1
   MailUser=dnxmat002@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:59:01 SAST 2025

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 00:59:55 SAST 2025

UCT HPC clusterJOB DETAILS FOR JOB 242799

captured Tue Aug 26 01:00:31 SAST 2025