Workunit 31545258

name JNK1_A38_A37_r2_1-QUICO_ATM_GAFF2_LOMAP_JNK1_2-0-5-RND8877
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 14:34:30 UTC
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
38580434 400693 11 Dec 2025, 14:34:41 UTC 11 Dec 2025, 15:27:45 UTC Aborted 2,437.63 2,131.73 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580488 648003 11 Dec 2025, 15:27:55 UTC 12 Dec 2025, 8:24:22 UTC Aborted 60,436.04 55,845.61 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580953 635604 12 Dec 2025, 8:24:32 UTC 12 Dec 2025, 11:21:12 UTC Aborted 10,518.73 6,427.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581619 602586 12 Dec 2025, 11:21:19 UTC 12 Dec 2025, 21:57:37 UTC Aborted 38,076.30 9,571.19 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582141 610109 12 Dec 2025, 21:57:44 UTC 15 Dec 2025, 23:17:41 UTC Error while computing 227,306.46 194,185.40 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38584035 642815 15 Dec 2025, 23:17:52 UTC 20 Dec 2025, 23:17:52 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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