Workunit 31585730

name BACE_A33_A01_r0_3-QUICO_ATM_OpenFF23_NAGL_BACE-4-6-RND0096
application ATM: Free energy calculations of protein-ligand binding
created 29 Apr 2026, 20:57:43 UTC
canonical result 38639673
granted credit 750,000.00
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
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38637795 624938 29 Apr 2026, 20:57:55 UTC 30 Apr 2026, 23:26:16 UTC Error while computing 98.73 26.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38639673 625602 30 Apr 2026, 23:26:37 UTC 2 May 2026, 12:25:41 UTC Completed and validated 28,119.45 28,119.45 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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