Workunit 31577426

name cdk8_A31_A19_r0_1-QUICO_ATM_GAFF2_NAGL_cdk8-0-6-RND0149
application ATM: Free energy calculations of protein-ligand binding
created 24 Apr 2026, 11:53:49 UTC
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
Task
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StatusRun time
(sec)
CPU time
(sec)
CreditApplication
38627443 646373 24 Apr 2026, 12:19:26 UTC 24 Apr 2026, 12:38:36 UTC Error while computing 55.61 18.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38627634 642776 24 Apr 2026, 12:40:45 UTC 24 Apr 2026, 12:47:27 UTC Error while computing 158.86 25.03 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38627669 583488 24 Apr 2026, 12:48:02 UTC 24 Apr 2026, 18:35:06 UTC Error while computing 100.94 18.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38628413 625441 24 Apr 2026, 18:35:14 UTC 24 Apr 2026, 19:08:40 UTC Error while computing 72.94 37.33 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38628475 652220 24 Apr 2026, 19:09:02 UTC 24 Apr 2026, 19:11:56 UTC Error while computing 73.45 11.80 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38628483 642860 24 Apr 2026, 19:12:14 UTC 24 Apr 2026, 23:49:35 UTC Error while computing 69.16 4.20 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38628972 650301 24 Apr 2026, 23:50:01 UTC 29 Apr 2026, 23:50:01 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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