Workunit 31545002

name JNK1_A09_A37_r1_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND1050
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:12:03 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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38579648 595174 11 Dec 2025, 13:12:07 UTC 11 Dec 2025, 13:21:47 UTC Error while computing 44.41 11.31 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579813 637171 11 Dec 2025, 13:21:53 UTC 11 Dec 2025, 13:26:44 UTC Error while computing 43.72 1.74 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579898 639495 11 Dec 2025, 13:26:49 UTC 11 Dec 2025, 13:31:16 UTC Error while computing 131.31 17.08 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579945 609955 11 Dec 2025, 13:31:24 UTC 11 Dec 2025, 13:37:23 UTC Error while computing 163.48 14.38 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579999 521288 11 Dec 2025, 13:37:34 UTC 11 Dec 2025, 13:40:43 UTC Error while computing 83.03 11.42 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580023 639108 11 Dec 2025, 13:40:53 UTC 11 Dec 2025, 14:04:04 UTC Error while computing 68.53 9.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580173 601928 11 Dec 2025, 14:04:10 UTC 11 Dec 2025, 14:12:57 UTC Error while computing 81.95 17.26 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580217 549691 11 Dec 2025, 14:13:05 UTC 12 Dec 2025, 1:59:01 UTC Error while computing 48.90 7.47 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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