JOB DETAILS FOR JOB 191853

captured Thu Jul 31 01:21:41 SAST 2025

MaxRAM=0.3G
MaxVMSize=0G
AveCPUFreq=3.35M
AveDiskRead=209456105
AveDiskWrite=255708400

JobId=191853 JobName=enamine_locator
   UserId=01430176(1221911089 Stephen Fienberg) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7624 Nice=0 Account=h3d QOS=normal
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:00:36 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2025-07-31T01:21:03 EligibleTime=2025-07-31T01:21:03
   AccrueTime=2025-07-31T01:21:03
   StartTime=2025-07-31T01:21:05 EndTime=2025-08-04T05:21:05 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-07-31T01:21:05 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc100:900810
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc108
   BatchHost=srvrochpc108
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=8000M,node=1,billing=1
   AllocTRES=cpu=1,mem=8000M,node=1,billing=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc108 CPU_IDs=0 Mem=8000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.batch
   WorkDir=/scratch/01430176/schrod_tmp/01430176/enamine_locator_PhaseDB-MANAGE_phase
   Comment=SchrodingerJobId=srvrochpc100-0-688aa8de 
   StdErr=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   StdIn=/dev/null
   StdOut=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   Power=
UCT HPC clusterJOB DETAILS FOR JOB 191853

captured Thu Jul 31 01:22:01 SAST 2025

JobId=191853 JobName=enamine_locator
   UserId=01430176(1221911089 Stephen Fienberg) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7624 Nice=0 Account=h3d QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:00:52 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2025-07-31T01:21:03 EligibleTime=2025-07-31T01:21:03
   AccrueTime=2025-07-31T01:21:03
   StartTime=2025-07-31T01:21:05 EndTime=2025-07-31T01:21:57 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-07-31T01:21:05 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc100:900810
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc108
   BatchHost=srvrochpc108
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=8000M,node=1,billing=1
   AllocTRES=cpu=1,mem=8000M,node=1,billing=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc108 CPU_IDs=0 Mem=8000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.batch
   WorkDir=/scratch/01430176/schrod_tmp/01430176/enamine_locator_PhaseDB-MANAGE_phase
   Comment=SchrodingerJobId=srvrochpc100-0-688aa8de 
   StdErr=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   StdIn=/dev/null
   StdOut=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   Power=
UCT HPC clusterJOB DETAILS FOR JOB 191853

captured Thu Jul 31 01:22:42 SAST 2025

JobId=191853 JobName=enamine_locator
   UserId=01430176(1221911089 Stephen Fienberg) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7624 Nice=0 Account=h3d QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:00:52 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2025-07-31T01:21:03 EligibleTime=2025-07-31T01:21:03
   AccrueTime=2025-07-31T01:21:03
   StartTime=2025-07-31T01:21:05 EndTime=2025-07-31T01:21:57 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-07-31T01:21:05 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc100:900810
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc108
   BatchHost=srvrochpc108
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=8000M,node=1,billing=1
   AllocTRES=cpu=1,mem=8000M,node=1,billing=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc108 CPU_IDs=0 Mem=8000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.batch
   WorkDir=/scratch/01430176/schrod_tmp/01430176/enamine_locator_PhaseDB-MANAGE_phase
   Comment=SchrodingerJobId=srvrochpc100-0-688aa8de 
   StdErr=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   StdIn=/dev/null
   StdOut=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   Power=
UCT HPC clusterJOB DETAILS FOR JOB 191853

captured Thu Jul 31 01:23:01 SAST 2025

JobId=191853 JobName=enamine_locator
   UserId=01430176(1221911089 Stephen Fienberg) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7624 Nice=0 Account=h3d QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:00:52 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2025-07-31T01:21:03 EligibleTime=2025-07-31T01:21:03
   AccrueTime=2025-07-31T01:21:03
   StartTime=2025-07-31T01:21:05 EndTime=2025-07-31T01:21:57 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-07-31T01:21:05 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc100:900810
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc108
   BatchHost=srvrochpc108
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=8000M,node=1,billing=1
   AllocTRES=cpu=1,mem=8000M,node=1,billing=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc108 CPU_IDs=0 Mem=8000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.batch
   WorkDir=/scratch/01430176/schrod_tmp/01430176/enamine_locator_PhaseDB-MANAGE_phase
   Comment=SchrodingerJobId=srvrochpc100-0-688aa8de 
   StdErr=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   StdIn=/dev/null
   StdOut=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   Power=
UCT HPC clusterJOB DETAILS FOR JOB 191853

captured Thu Jul 31 01:23:41 SAST 2025

JobId=191853 JobName=enamine_locator
   UserId=01430176(1221911089 Stephen Fienberg) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7624 Nice=0 Account=h3d QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:00:52 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2025-07-31T01:21:03 EligibleTime=2025-07-31T01:21:03
   AccrueTime=2025-07-31T01:21:03
   StartTime=2025-07-31T01:21:05 EndTime=2025-07-31T01:21:57 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-07-31T01:21:05 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc100:900810
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc108
   BatchHost=srvrochpc108
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=8000M,node=1,billing=1
   AllocTRES=cpu=1,mem=8000M,node=1,billing=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc108 CPU_IDs=0 Mem=8000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.batch
   WorkDir=/scratch/01430176/schrod_tmp/01430176/enamine_locator_PhaseDB-MANAGE_phase
   Comment=SchrodingerJobId=srvrochpc100-0-688aa8de 
   StdErr=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   StdIn=/dev/null
   StdOut=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   Power=
UCT HPC clusterJOB DETAILS FOR JOB 191853

captured Thu Jul 31 01:24:01 SAST 2025

JobId=191853 JobName=enamine_locator
   UserId=01430176(1221911089 Stephen Fienberg) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7624 Nice=0 Account=h3d QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:00:52 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2025-07-31T01:21:03 EligibleTime=2025-07-31T01:21:03
   AccrueTime=2025-07-31T01:21:03
   StartTime=2025-07-31T01:21:05 EndTime=2025-07-31T01:21:57 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-07-31T01:21:05 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc100:900810
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc108
   BatchHost=srvrochpc108
   NumNodes=1 NumCPUs=1 NumTasks=1 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=1,mem=8000M,node=1,billing=1
   AllocTRES=cpu=1,mem=8000M,node=1,billing=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc108 CPU_IDs=0 Mem=8000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.batch
   WorkDir=/scratch/01430176/schrod_tmp/01430176/enamine_locator_PhaseDB-MANAGE_phase
   Comment=SchrodingerJobId=srvrochpc100-0-688aa8de 
   StdErr=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   StdIn=/dev/null
   StdOut=/home/01430176/.schrodinger/.jobdb2/files/srvrochpc100-688aa/srvrochpc100-0-688aa8de.qlog
   Power=