Workunit 31585777

name BACE_A29_A09_r0_2-QUICO_ATM_OpenFF23_NAGL_BACE-3-6-RND9790
application ATM: Free energy calculations of protein-ligand binding
created 29 Apr 2026, 21:28:45 UTC
canonical result 38638299
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
38637854 551601 29 Apr 2026, 21:28:53 UTC 29 Apr 2026, 21:58:27 UTC Error while computing 86.72 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38637887 650701 29 Apr 2026, 21:58:47 UTC 30 Apr 2026, 4:09:27 UTC Error while computing 100.58 18.79 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38638299 651946 30 Apr 2026, 4:09:43 UTC 30 Apr 2026, 22:57:22 UTC Completed and validated 16,612.25 15,499.13 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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