Workunit 31545015

name JNK1_A14_A09_r4_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND2946
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:13:14 UTC
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
errors Too many errors (may have bug)
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StatusRun time
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CPU time
(sec)
CreditApplication
38579661 579678 11 Dec 2025, 13:13:22 UTC 11 Dec 2025, 13:58:54 UTC Error while computing 106.08 22.83 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580145 536866 11 Dec 2025, 13:59:03 UTC 11 Dec 2025, 14:49:51 UTC Error while computing 679.04 28.59 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580456 631745 11 Dec 2025, 14:50:00 UTC 11 Dec 2025, 14:56:15 UTC Error while computing 163.04 18.80 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580464 642631 11 Dec 2025, 14:56:22 UTC 11 Dec 2025, 15:02:32 UTC Error while computing 237.20 32.47 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580468 647893 11 Dec 2025, 15:02:46 UTC 11 Dec 2025, 15:07:59 UTC Error while computing 170.40 23.69 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580474 625608 11 Dec 2025, 15:08:07 UTC 11 Dec 2025, 15:22:20 UTC Error while computing 57.33 8.55 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580485 632103 11 Dec 2025, 15:22:26 UTC 11 Dec 2025, 15:41:38 UTC Error while computing 80.60 3.91 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580499 549890 11 Dec 2025, 15:41:50 UTC 11 Dec 2025, 15:47:04 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580502 537426 11 Dec 2025, 15:47:13 UTC 11 Dec 2025, 15:50:18 UTC Error while computing 66.72 15.18 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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