Workunit 31578797

name MCL1_RE_A06_A16_r0_5-QUICO_ATM_OpenFF23_NAGL_MCL1_RE-3-6-RND1764
application ATM: Free energy calculations of protein-ligand binding
created 25 Apr 2026, 2:53:12 UTC
canonical result 38630642
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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StatusRun time
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CPU time
(sec)
CreditApplication
38629303 651760 25 Apr 2026, 2:53:20 UTC 25 Apr 2026, 14:57:46 UTC Error while computing 38.21 0.33 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38630634 640476 25 Apr 2026, 14:58:09 UTC 25 Apr 2026, 15:02:37 UTC Error while computing 35.75 7.88 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38630642 643562 25 Apr 2026, 15:02:46 UTC 25 Apr 2026, 19:58:48 UTC Completed and validated 17,305.80 16,939.64 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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