Workunit 31577447

name cdk8_A31_A25_r0_3-QUICO_ATM_GAFF2_NAGL_cdk8-0-6-RND3529
application ATM: Free energy calculations of protein-ligand binding
created 24 Apr 2026, 11:55:08 UTC
canonical result 38637562
granted credit 750,000.00
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
38627466 648092 24 Apr 2026, 12:18:39 UTC 24 Apr 2026, 12:19:02 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38627558 642764 24 Apr 2026, 12:19:07 UTC 24 Apr 2026, 12:27:41 UTC Error while computing 51.64 4.22 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38627595 643187 24 Apr 2026, 12:27:51 UTC 4 May 2026, 3:03:23 UTC Completed, too late to validate 36,370.89 36,269.69 0.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38636956 610880 29 Apr 2026, 12:28:04 UTC 29 Apr 2026, 17:55:33 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38637562 611154 29 Apr 2026, 17:55:55 UTC 30 Apr 2026, 7:36:41 UTC Completed and validated 32,342.41 32,342.41 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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