UCT HPC cluster

JOB DETAILS FOR JOB 93766

captured Tue Mar 11 21:45:34 SAST 2025

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

JobId=93766 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7323 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=1-11:12:43 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-03-10T10:32:51 EligibleTime=2025-03-10T10:32:51
   AccrueTime=2025-03-10T10:32:51
   StartTime=2025-03-10T10:32:51 EndTime=2025-03-12T10:32:51 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-03-10T10:32:51 Scheduler=Backfill
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:2688419
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu013
   BatchHost=srvrocgpu013
   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=srvrocgpu013 CPU_IDs=24 Mem=10000 GRES=gpu:l40s:1(IDX:0)
   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/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.batch
   WorkDir=/scratch/chdbha001/5EZR-MD/H3D-025366/desmond_md_5EZR-H3D025366
   Comment=SchrodingerJobId=srvrochpc001-0-67cea3b1 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 93766

captured Tue Mar 11 21:46:01 SAST 2025

JobId=93766 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7323 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=1-11:12:44 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-03-10T10:32:51 EligibleTime=2025-03-10T10:32:51
   AccrueTime=2025-03-10T10:32:51
   StartTime=2025-03-10T10:32:51 EndTime=2025-03-11T21:45:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-03-10T10:32:51 Scheduler=Backfill
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:2688419
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu013
   BatchHost=srvrocgpu013
   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=srvrocgpu013 CPU_IDs=24 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/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.batch
   WorkDir=/scratch/chdbha001/5EZR-MD/H3D-025366/desmond_md_5EZR-H3D025366
   Comment=SchrodingerJobId=srvrochpc001-0-67cea3b1 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 93766

captured Tue Mar 11 21:46:34 SAST 2025

JobId=93766 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7323 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=1-11:12:44 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-03-10T10:32:51 EligibleTime=2025-03-10T10:32:51
   AccrueTime=2025-03-10T10:32:51
   StartTime=2025-03-10T10:32:51 EndTime=2025-03-11T21:45:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-03-10T10:32:51 Scheduler=Backfill
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:2688419
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu013
   BatchHost=srvrocgpu013
   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=srvrocgpu013 CPU_IDs=24 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/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.batch
   WorkDir=/scratch/chdbha001/5EZR-MD/H3D-025366/desmond_md_5EZR-H3D025366
   Comment=SchrodingerJobId=srvrochpc001-0-67cea3b1 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 93766

captured Tue Mar 11 21:47:01 SAST 2025

JobId=93766 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7323 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=1-11:12:44 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-03-10T10:32:51 EligibleTime=2025-03-10T10:32:51
   AccrueTime=2025-03-10T10:32:51
   StartTime=2025-03-10T10:32:51 EndTime=2025-03-11T21:45:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-03-10T10:32:51 Scheduler=Backfill
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:2688419
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu013
   BatchHost=srvrocgpu013
   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=srvrocgpu013 CPU_IDs=24 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/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.batch
   WorkDir=/scratch/chdbha001/5EZR-MD/H3D-025366/desmond_md_5EZR-H3D025366
   Comment=SchrodingerJobId=srvrochpc001-0-67cea3b1 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1

UCT HPC clusterJOB DETAILS FOR JOB 93766

captured Tue Mar 11 21:47:34 SAST 2025

JobId=93766 JobName=desmond_md_5EZR
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7323 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=1-11:12:44 TimeLimit=2-00:00:00 TimeMin=N/A
   SubmitTime=2025-03-10T10:32:51 EligibleTime=2025-03-10T10:32:51
   AccrueTime=2025-03-10T10:32:51
   StartTime=2025-03-10T10:32:51 EndTime=2025-03-11T21:45:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-03-10T10:32:51 Scheduler=Backfill
   Partition=l40s AllocNode:Sid=srvrochpc001.uct.ac.za:2688419
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu013
   BatchHost=srvrocgpu013
   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=srvrocgpu013 CPU_IDs=24 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/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.batch
   WorkDir=/scratch/chdbha001/5EZR-MD/H3D-025366/desmond_md_5EZR-H3D025366
   Comment=SchrodingerJobId=srvrochpc001-0-67cea3b1 
   StdErr=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   StdIn=/dev/null
   StdOut=/home/chdbha001/.schrodinger/.jobdb2/files/srvrochpc001-67cea/srvrochpc001-0-67cea3b1.qlog
   Power=
   TresPerNode=gres/gpu:l40s:1