UCT HPC cluster

JOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:13:33 SAST 2026

MaxRAM=0G
MaxVMSize=0G
AveCPUFreq=
AveDiskRead=
AveDiskWrite=

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:09 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T11:14:24 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=gpu:ampere:1(IDX:2)
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:14:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:14:33 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:15:02 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:15:34 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:16:02 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:16:35 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:17:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:17:35 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:18:02 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:18:35 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:19:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:19:34 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:20:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:20:35 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:21:02 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:21:35 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:22:02 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:22:35 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:23:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:23:34 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:24:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:24:36 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:25:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:25:35 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4

UCT HPC clusterJOB DETAILS FOR JOB 1612052

captured Mon Nov 9 10:26:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7782 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:59:10 TimeLimit=02:00:00 TimeMin=N/A
   SubmitTime=2026-11-09T09:14:23 EligibleTime=2026-11-09T09:14:24
   AccrueTime=Unknown
   StartTime=2026-11-09T09:14:24 EndTime=2026-11-09T10:13:34 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-11-09T09:14:24 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc104:2619246
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=4 NumTasks=1 CPUs/Task=4 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=4,mem=32G,node=1,billing=8,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-11 Mem=32768 GRES=
   MinCPUsNode=4 MinMemoryNode=32G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/recovery_utf8_v1/jobs/gpu_utf8.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2
   StdErr=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.err
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_scage_benchmark_v1/chemeleon_tuning_v2/logs/cheme_utf8_gpu_1612052_2.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:4