UCT HPC cluster

JOB DETAILS FOR JOB 111503

captured Thu Apr 17 23:40:35 SAST 2025

MaxRAM=7.5G
MaxVMSize=0G
AveCPUFreq=18K
AveDiskRead=5039177618
AveDiskWrite=1381530704

JobId=111503 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7279 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=1-09:16:31 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-04-16T14:24:04 EligibleTime=2025-04-16T14:24:04
   AccrueTime=2025-04-16T14:24:04
   StartTime=2025-04-16T14:24:04 EndTime=2025-04-18T14:24:04 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-04-16T14:24:04 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:1201264
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=10000M,node=1,billing=1,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=1,mem=10000M,node=1,billing=1,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=27 Mem=10000 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/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.batch
   WorkDir=/scratch/chdbha001/MD/MPL-192/desmond_md_5EZR-MPL192
   Comment=SchrodingerJobId=srvrochpc001-0-67ffa161 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 111503

captured Thu Apr 17 23:41:01 SAST 2025

JobId=111503 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7279 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-09:16:49 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-04-16T14:24:04 EligibleTime=2025-04-16T14:24:04
   AccrueTime=2025-04-16T14:24:04
   StartTime=2025-04-16T14:24:04 EndTime=2025-04-17T23:40:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-04-16T14:24:04 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:1201264
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=10000M,node=1,billing=1,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=1,mem=10000M,node=1,billing=1,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=27 Mem=10000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.batch
   WorkDir=/scratch/chdbha001/MD/MPL-192/desmond_md_5EZR-MPL192
   Comment=SchrodingerJobId=srvrochpc001-0-67ffa161 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 111503

captured Thu Apr 17 23:41:34 SAST 2025

JobId=111503 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7279 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-09:16:49 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-04-16T14:24:04 EligibleTime=2025-04-16T14:24:04
   AccrueTime=2025-04-16T14:24:04
   StartTime=2025-04-16T14:24:04 EndTime=2025-04-17T23:40:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-04-16T14:24:04 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:1201264
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=10000M,node=1,billing=1,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=1,mem=10000M,node=1,billing=1,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=27 Mem=10000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.batch
   WorkDir=/scratch/chdbha001/MD/MPL-192/desmond_md_5EZR-MPL192
   Comment=SchrodingerJobId=srvrochpc001-0-67ffa161 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 111503

captured Thu Apr 17 23:42:01 SAST 2025

JobId=111503 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7279 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-09:16:49 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-04-16T14:24:04 EligibleTime=2025-04-16T14:24:04
   AccrueTime=2025-04-16T14:24:04
   StartTime=2025-04-16T14:24:04 EndTime=2025-04-17T23:40:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-04-16T14:24:04 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:1201264
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=10000M,node=1,billing=1,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=1,mem=10000M,node=1,billing=1,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=27 Mem=10000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.batch
   WorkDir=/scratch/chdbha001/MD/MPL-192/desmond_md_5EZR-MPL192
   Comment=SchrodingerJobId=srvrochpc001-0-67ffa161 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 111503

captured Thu Apr 17 23:42:34 SAST 2025

JobId=111503 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7279 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-09:16:49 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-04-16T14:24:04 EligibleTime=2025-04-16T14:24:04
   AccrueTime=2025-04-16T14:24:04
   StartTime=2025-04-16T14:24:04 EndTime=2025-04-17T23:40:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-04-16T14:24:04 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:1201264
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=10000M,node=1,billing=1,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=1,mem=10000M,node=1,billing=1,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=27 Mem=10000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.batch
   WorkDir=/scratch/chdbha001/MD/MPL-192/desmond_md_5EZR-MPL192
   Comment=SchrodingerJobId=srvrochpc001-0-67ffa161 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 111503

captured Thu Apr 17 23:43:01 SAST 2025

JobId=111503 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7279 Nice=0 Account=l40sfree QOS=l40sfree
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-09:16:49 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-04-16T14:24:04 EligibleTime=2025-04-16T14:24:04
   AccrueTime=2025-04-16T14:24:04
   StartTime=2025-04-16T14:24:04 EndTime=2025-04-17T23:40:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-04-16T14:24:04 Scheduler=Main
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:1201264
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu012
   BatchHost=srvrocgpu012
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=10000M,node=1,billing=1,gres/gpu=1,gres/gpu:l40s=1
   AllocTRES=cpu=1,mem=10000M,node=1,billing=1,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=27 Mem=10000 GRES=
   MinCPUsNode=1 MinMemoryCPU=10000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.batch
   WorkDir=/scratch/chdbha001/MD/MPL-192/desmond_md_5EZR-MPL192
   Comment=SchrodingerJobId=srvrochpc001-0-67ffa161 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67ffa/srvrochpc001-0-67ffa161.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1