Workunit 31577565

name cdk8_A20_A26_r0_1-QUICO_ATM_OpenFF23_NAGL_cdk8-1-6-RND9014
application ATM: Free energy calculations of protein-ligand binding
created 24 Apr 2026, 13:01:22 UTC
canonical result 38627986
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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38627713 640476 24 Apr 2026, 13:01:42 UTC 24 Apr 2026, 13:07:24 UTC Error while computing 77.32 28.01 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38627742 124372 24 Apr 2026, 13:08:06 UTC 24 Apr 2026, 13:11:15 UTC Error while computing 70.76 1.22 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38627756 651915 24 Apr 2026, 13:13:10 UTC 24 Apr 2026, 14:55:10 UTC Error while computing 5,798.39 5,798.39 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38627986 652185 24 Apr 2026, 14:55:47 UTC 25 Apr 2026, 0:43:23 UTC Completed and validated 13,840.96 13,767.23 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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