Workunit 31586267

name p38_3_A23_A08_r0_2-QUICO_ATM_OpenFF_NAGL_p38_3-3-6-RND7959
application ATM: Free energy calculations of protein-ligand binding
created 30 Apr 2026, 6:34:29 UTC
canonical result 38638681
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
38638478 637552 30 Apr 2026, 6:34:42 UTC 30 Apr 2026, 9:26:05 UTC Error while computing 10,022.92 9,144.96 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38638681 648967 30 Apr 2026, 9:26:14 UTC 6 May 2026, 15:21:14 UTC Completed and validated 20,061.47 20,061.47 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38642168 603782 5 May 2026, 9:26:18 UTC 10 May 2026, 9:27:11 UTC Not started by deadline - canceled 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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