JOB DETAILS FOR JOB 1441931

captured Mon Oct 12 11:44:38 SAST 2026

MaxRAM=1.1G
MaxVMSize=0G
AveCPUFreq=2M
AveDiskRead=970103744
AveDiskWrite=2518240297

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7691 Nice=0 Account=a100free QOS=a100free
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:04:46 TimeLimit=01:00:00 TimeMin=N/A
   SubmitTime=2026-10-12T11:39:51 EligibleTime=2026-10-12T11:39:51
   AccrueTime=2026-10-12T11:39:52
   StartTime=2026-10-12T11:39:52 EndTime=2026-10-12T12:39:52 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-10-12T11:39:52 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc001:2932392
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=2 NumTasks=1 CPUs/Task=2 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-9 Mem=16384 GRES=gpu:ampere:1(IDX:2)
   MinCPUsNode=2 MinMemoryNode=16G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/jobs/gpu_bundle.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1
   StdErr=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:2
UCT HPC clusterJOB DETAILS FOR JOB 1441931

captured Mon Oct 12 11:45:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7691 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:04:53 TimeLimit=01:00:00 TimeMin=N/A
   SubmitTime=2026-10-12T11:39:51 EligibleTime=2026-10-12T11:39:51
   AccrueTime=2026-10-12T11:39:52
   StartTime=2026-10-12T11:39:52 EndTime=2026-10-12T11:44:45 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-10-12T11:39:52 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc001:2932392
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=2 NumTasks=1 CPUs/Task=2 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-9 Mem=16384 GRES=
   MinCPUsNode=2 MinMemoryNode=16G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/jobs/gpu_bundle.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1
   StdErr=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:2
UCT HPC clusterJOB DETAILS FOR JOB 1441931

captured Mon Oct 12 11:45:38 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7691 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:04:53 TimeLimit=01:00:00 TimeMin=N/A
   SubmitTime=2026-10-12T11:39:51 EligibleTime=2026-10-12T11:39:51
   AccrueTime=2026-10-12T11:39:52
   StartTime=2026-10-12T11:39:52 EndTime=2026-10-12T11:44:45 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-10-12T11:39:52 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc001:2932392
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=2 NumTasks=1 CPUs/Task=2 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-9 Mem=16384 GRES=
   MinCPUsNode=2 MinMemoryNode=16G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/jobs/gpu_bundle.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1
   StdErr=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:2
UCT HPC clusterJOB DETAILS FOR JOB 1441931

captured Mon Oct 12 11:46:01 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7691 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:04:53 TimeLimit=01:00:00 TimeMin=N/A
   SubmitTime=2026-10-12T11:39:51 EligibleTime=2026-10-12T11:39:51
   AccrueTime=2026-10-12T11:39:52
   StartTime=2026-10-12T11:39:52 EndTime=2026-10-12T11:44:45 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-10-12T11:39:52 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc001:2932392
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=2 NumTasks=1 CPUs/Task=2 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-9 Mem=16384 GRES=
   MinCPUsNode=2 MinMemoryNode=16G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/jobs/gpu_bundle.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1
   StdErr=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:2
UCT HPC clusterJOB DETAILS FOR JOB 1441931

captured Mon Oct 12 11:46:37 SAST 2026

bxxjin001(465013408 Jinming Bai) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7691 Nice=0 Account=a100free QOS=a100free
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=00:04:53 TimeLimit=01:00:00 TimeMin=N/A
   SubmitTime=2026-10-12T11:39:51 EligibleTime=2026-10-12T11:39:51
   AccrueTime=2026-10-12T11:39:52
   StartTime=2026-10-12T11:39:52 EndTime=2026-10-12T11:44:45 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2026-10-12T11:39:52 Scheduler=Main
   Partition=a100 AllocNode:Sid=srvrochpc001:2932392
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrocgpu010
   BatchHost=srvrocgpu010
   NumNodes=1 NumCPUs=2 NumTasks=1 CPUs/Task=2 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   AllocTRES=cpu=2,mem=16G,node=1,billing=4,gres/gpu=1,gres/gpu:ampere=1
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=gpu:ampere:1
     Nodes=srvrocgpu010 CPU_IDs=8-9 Mem=16384 GRES=
   MinCPUsNode=2 MinMemoryNode=16G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/jobs/gpu_bundle.sbatch
   WorkDir=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1
   StdErr=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   StdIn=/dev/null
   StdOut=/scratch/bxxjin001/ORION/molecular_complementary_knowledge_v1/pilot_v1/logs/gpu_1441931.out
   Power=
   TresPerNode=gres/gpu:ampere:1
   TresPerTask=cpu:2