UCT HPC cluster

JOB DETAILS FOR JOB 602552

captured Tue Mar 17 09:19:01 SAST 2026

MaxRAM=7.1G
MaxVMSize=0G
AveCPUFreq=1M
AveDiskRead=44689764388
AveDiskWrite=3634857942

mnxcar010(291290927 Carol Maina) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6985 Nice=0 Account=chemistry QOS=normal
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=20:09:33 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2026-03-16T13:09:21 EligibleTime=2026-03-16T13:09:21
   AccrueTime=2026-03-16T13:09:21
   StartTime=2026-03-16T13:09:28 EndTime=2026-03-19T13:09:28 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-03-16T13:09:28 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2612317
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc204
   BatchHost=srvrochpc204
   NumNodes=1 NumCPUs=32 NumTasks=32 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=32,mem=250G,node=1,billing=57
   AllocTRES=cpu=32,mem=250G,node=1,billing=57
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc204 CPU_IDs=0-15,20-35 Mem=256000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/mnxcar010/script_apo.sh
   WorkDir=/home/mnxcar010
   StdErr=/home/mnxcar010/gmx_test_error.txt
   StdIn=/dev/null
   StdOut=/home/mnxcar010/gmx_test_output.txt
   Power=
   MailUser=mnxcar010@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 602552

captured Tue Mar 17 09:19:35 SAST 2026

mnxcar010(291290927 Carol Maina) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6985 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=20:10:04 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2026-03-16T13:09:21 EligibleTime=2026-03-16T13:09:21
   AccrueTime=2026-03-16T13:09:21
   StartTime=2026-03-16T13:09:28 EndTime=2026-03-17T09:19:32 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-03-16T13:09:28 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2612317
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc204
   BatchHost=srvrochpc204
   NumNodes=1 NumCPUs=32 NumTasks=32 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=32,mem=250G,node=1,billing=57
   AllocTRES=cpu=32,mem=250G,node=1,billing=57
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc204 CPU_IDs=0-15,20-35 Mem=256000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/mnxcar010/script_apo.sh
   WorkDir=/home/mnxcar010
   StdErr=/home/mnxcar010/gmx_test_error.txt
   StdIn=/dev/null
   StdOut=/home/mnxcar010/gmx_test_output.txt
   Power=
   MailUser=mnxcar010@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 602552

captured Tue Mar 17 09:20:01 SAST 2026

mnxcar010(291290927 Carol Maina) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6985 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=20:10:04 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2026-03-16T13:09:21 EligibleTime=2026-03-16T13:09:21
   AccrueTime=2026-03-16T13:09:21
   StartTime=2026-03-16T13:09:28 EndTime=2026-03-17T09:19:32 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-03-16T13:09:28 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2612317
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc204
   BatchHost=srvrochpc204
   NumNodes=1 NumCPUs=32 NumTasks=32 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=32,mem=250G,node=1,billing=57
   AllocTRES=cpu=32,mem=250G,node=1,billing=57
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc204 CPU_IDs=0-15,20-35 Mem=256000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/mnxcar010/script_apo.sh
   WorkDir=/home/mnxcar010
   StdErr=/home/mnxcar010/gmx_test_error.txt
   StdIn=/dev/null
   StdOut=/home/mnxcar010/gmx_test_output.txt
   Power=
   MailUser=mnxcar010@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 602552

captured Tue Mar 17 09:20:36 SAST 2026

mnxcar010(291290927 Carol Maina) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6985 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=20:10:04 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2026-03-16T13:09:21 EligibleTime=2026-03-16T13:09:21
   AccrueTime=2026-03-16T13:09:21
   StartTime=2026-03-16T13:09:28 EndTime=2026-03-17T09:19:32 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-03-16T13:09:28 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2612317
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc204
   BatchHost=srvrochpc204
   NumNodes=1 NumCPUs=32 NumTasks=32 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=32,mem=250G,node=1,billing=57
   AllocTRES=cpu=32,mem=250G,node=1,billing=57
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc204 CPU_IDs=0-15,20-35 Mem=256000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/mnxcar010/script_apo.sh
   WorkDir=/home/mnxcar010
   StdErr=/home/mnxcar010/gmx_test_error.txt
   StdIn=/dev/null
   StdOut=/home/mnxcar010/gmx_test_output.txt
   Power=
   MailUser=mnxcar010@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 602552

captured Tue Mar 17 09:21:01 SAST 2026

mnxcar010(291290927 Carol Maina) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6985 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=20:10:04 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2026-03-16T13:09:21 EligibleTime=2026-03-16T13:09:21
   AccrueTime=2026-03-16T13:09:21
   StartTime=2026-03-16T13:09:28 EndTime=2026-03-17T09:19:32 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-03-16T13:09:28 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2612317
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc204
   BatchHost=srvrochpc204
   NumNodes=1 NumCPUs=32 NumTasks=32 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=32,mem=250G,node=1,billing=57
   AllocTRES=cpu=32,mem=250G,node=1,billing=57
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc204 CPU_IDs=0-15,20-35 Mem=256000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/mnxcar010/script_apo.sh
   WorkDir=/home/mnxcar010
   StdErr=/home/mnxcar010/gmx_test_error.txt
   StdIn=/dev/null
   StdOut=/home/mnxcar010/gmx_test_output.txt
   Power=
   MailUser=mnxcar010@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 602552

captured Tue Mar 17 09:21:35 SAST 2026

mnxcar010(291290927 Carol Maina) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6985 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=20:10:04 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2026-03-16T13:09:21 EligibleTime=2026-03-16T13:09:21
   AccrueTime=2026-03-16T13:09:21
   StartTime=2026-03-16T13:09:28 EndTime=2026-03-17T09:19:32 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-03-16T13:09:28 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2612317
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc204
   BatchHost=srvrochpc204
   NumNodes=1 NumCPUs=32 NumTasks=32 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=32,mem=250G,node=1,billing=57
   AllocTRES=cpu=32,mem=250G,node=1,billing=57
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc204 CPU_IDs=0-15,20-35 Mem=256000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/mnxcar010/script_apo.sh
   WorkDir=/home/mnxcar010
   StdErr=/home/mnxcar010/gmx_test_error.txt
   StdIn=/dev/null
   StdOut=/home/mnxcar010/gmx_test_output.txt
   Power=
   MailUser=mnxcar010@myuct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT