Workunit 31577434

name cdk8_A31_A23_r0_2-QUICO_ATM_GAFF2_NAGL_cdk8-0-6-RND7486
application ATM: Free energy calculations of protein-ligand binding
created 24 Apr 2026, 11:54:15 UTC
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
Task
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ComputerSentTime reported
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StatusRun time
(sec)
CPU time
(sec)
CreditApplication
38627451 638259 24 Apr 2026, 12:10:41 UTC 24 Apr 2026, 12:50:08 UTC Error while computing 145.70 18.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38627680 637551 24 Apr 2026, 12:50:36 UTC 24 Apr 2026, 19:25:57 UTC Error while computing 50.11 8.16 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38628509 652183 24 Apr 2026, 19:26:08 UTC 24 Apr 2026, 23:25:18 UTC Error while computing 73.04 12.97 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38628929 605111 24 Apr 2026, 23:25:56 UTC 24 Apr 2026, 23:46:32 UTC Error while computing 72.66 9.92 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38628963 646979 24 Apr 2026, 23:46:50 UTC 25 Apr 2026, 2:34:05 UTC Error while computing 60.72 2.86 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38629273 649791 25 Apr 2026, 2:34:21 UTC 25 Apr 2026, 7:55:56 UTC Error while computing 72.09 3.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38629830 606795 25 Apr 2026, 7:56:03 UTC 30 Apr 2026, 7:56:03 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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