Workunit 31589439

name BACE_A33_A22_r0_2-QUICO_ATM_OpenFF23_NAGL_BACE-5-6-RND4505
application ATM: Free energy calculations of protein-ligand binding
created 7 May 2026, 2:39:21 UTC
canonical result 38642946
granted credit 750,000.00
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
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38642791 649816 7 May 2026, 2:39:27 UTC 7 May 2026, 9:02:04 UTC Error while computing 45.17 9.04 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38642946 652458 7 May 2026, 9:02:08 UTC 7 May 2026, 13:35:00 UTC Completed and validated 15,965.72 13,896.70 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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