JOB DETAILS FOR JOB 51343

captured Tue Nov 19 17:11:01 SAST 2024

MaxRAM=0.7G
MaxVMSize=0G
AveCPUFreq=2.60M
AveDiskRead=146125418
AveDiskWrite=5630

JobId=51343 JobName=Chemdiv_cpd_cov_dock_NuDB_3
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7594 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=00:00:07 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2024-11-19T17:10:54 EligibleTime=2024-11-19T17:10:54
   AccrueTime=2024-11-19T17:10:54
   StartTime=2024-11-19T17:10:54 EndTime=2024-11-23T21:10:54 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2024-11-19T17:10:54 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3695482
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc103
   BatchHost=srvrochpc103
   NumNodes=1 NumCPUs=12 NumTasks=12 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=96000M,node=1,billing=21
   AllocTRES=cpu=12,mem=96000M,node=1,billing=21
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc103 CPU_IDs=0-5,24-29 Mem=96000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/Ser98_cpd_cov_dock_Chemdiv-NuDB.sh
   WorkDir=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB
   StdErr=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   StdIn=/dev/null
   StdOut=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   Power=
   MailUser=bhanwar.choudhary@uct.ac.za MailType=BEGIN,END,FAIL
UCT HPC clusterJOB DETAILS FOR JOB 51343

captured Tue Nov 19 17:11:37 SAST 2024

JobId=51343 JobName=Chemdiv_cpd_cov_dock_NuDB_3
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7594 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=00:00:15 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2024-11-19T17:10:54 EligibleTime=2024-11-19T17:10:54
   AccrueTime=2024-11-19T17:10:54
   StartTime=2024-11-19T17:10:54 EndTime=2024-11-19T17:11:09 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2024-11-19T17:10:54 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3695482
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc103
   BatchHost=srvrochpc103
   NumNodes=1 NumCPUs=12 NumTasks=12 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=96000M,node=1,billing=21
   AllocTRES=cpu=12,mem=96000M,node=1,billing=21
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc103 CPU_IDs=0-5,24-29 Mem=96000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/Ser98_cpd_cov_dock_Chemdiv-NuDB.sh
   WorkDir=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB
   StdErr=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   StdIn=/dev/null
   StdOut=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   Power=
   MailUser=bhanwar.choudhary@uct.ac.za MailType=BEGIN,END,FAIL
UCT HPC clusterJOB DETAILS FOR JOB 51343

captured Tue Nov 19 17:12:01 SAST 2024

JobId=51343 JobName=Chemdiv_cpd_cov_dock_NuDB_3
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7594 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=00:00:15 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2024-11-19T17:10:54 EligibleTime=2024-11-19T17:10:54
   AccrueTime=2024-11-19T17:10:54
   StartTime=2024-11-19T17:10:54 EndTime=2024-11-19T17:11:09 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2024-11-19T17:10:54 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3695482
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc103
   BatchHost=srvrochpc103
   NumNodes=1 NumCPUs=12 NumTasks=12 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=96000M,node=1,billing=21
   AllocTRES=cpu=12,mem=96000M,node=1,billing=21
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc103 CPU_IDs=0-5,24-29 Mem=96000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/Ser98_cpd_cov_dock_Chemdiv-NuDB.sh
   WorkDir=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB
   StdErr=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   StdIn=/dev/null
   StdOut=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   Power=
   MailUser=bhanwar.choudhary@uct.ac.za MailType=BEGIN,END,FAIL
UCT HPC clusterJOB DETAILS FOR JOB 51343

captured Tue Nov 19 17:12:37 SAST 2024

JobId=51343 JobName=Chemdiv_cpd_cov_dock_NuDB_3
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7594 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=00:00:15 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2024-11-19T17:10:54 EligibleTime=2024-11-19T17:10:54
   AccrueTime=2024-11-19T17:10:54
   StartTime=2024-11-19T17:10:54 EndTime=2024-11-19T17:11:09 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2024-11-19T17:10:54 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3695482
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc103
   BatchHost=srvrochpc103
   NumNodes=1 NumCPUs=12 NumTasks=12 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=96000M,node=1,billing=21
   AllocTRES=cpu=12,mem=96000M,node=1,billing=21
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc103 CPU_IDs=0-5,24-29 Mem=96000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/Ser98_cpd_cov_dock_Chemdiv-NuDB.sh
   WorkDir=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB
   StdErr=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   StdIn=/dev/null
   StdOut=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   Power=
   MailUser=bhanwar.choudhary@uct.ac.za MailType=BEGIN,END,FAIL
UCT HPC clusterJOB DETAILS FOR JOB 51343

captured Tue Nov 19 17:13:01 SAST 2024

JobId=51343 JobName=Chemdiv_cpd_cov_dock_NuDB_3
   UserId=chdbha001(465174794 Bhanwar Choudhary) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7594 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=00:00:15 TimeLimit=4-04:00:00 TimeMin=N/A
   SubmitTime=2024-11-19T17:10:54 EligibleTime=2024-11-19T17:10:54
   AccrueTime=2024-11-19T17:10:54
   StartTime=2024-11-19T17:10:54 EndTime=2024-11-19T17:11:09 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2024-11-19T17:10:54 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3695482
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc103
   BatchHost=srvrochpc103
   NumNodes=1 NumCPUs=12 NumTasks=12 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=96000M,node=1,billing=21
   AllocTRES=cpu=12,mem=96000M,node=1,billing=21
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc103 CPU_IDs=0-5,24-29 Mem=96000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/Ser98_cpd_cov_dock_Chemdiv-NuDB.sh
   WorkDir=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB
   StdErr=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   StdIn=/dev/null
   StdOut=/scratch/chdbha001/Clp-Ser98-Cov-NuDB/covalent_docking_6VGQ_Ser98_Chemdiv-Ser-Prot-Inh-31972_NuDB/slurm-51343.out
   Power=
   MailUser=bhanwar.choudhary@uct.ac.za MailType=BEGIN,END,FAIL