Workunit 31545112

name JNK1_A31_A38_r1_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND6550
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:22:17 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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38579825 526681 11 Dec 2025, 13:22:23 UTC 11 Dec 2025, 13:32:58 UTC Error while computing 362.55 86.66 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579961 643097 11 Dec 2025, 13:33:10 UTC 11 Dec 2025, 13:36:13 UTC Error while computing 71.26 2.09 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579993 615763 11 Dec 2025, 13:36:23 UTC 11 Dec 2025, 13:42:31 UTC Error while computing 154.49 26.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580033 627850 11 Dec 2025, 13:42:38 UTC 11 Dec 2025, 22:01:06 UTC Error while computing 306.08 42.03 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580773 592403 11 Dec 2025, 22:01:17 UTC 11 Dec 2025, 22:25:24 UTC Error while computing 253.89 50.67 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580790 645721 11 Dec 2025, 22:25:35 UTC 11 Dec 2025, 22:38:19 UTC Error while computing 63.27 19.67 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580795 618582 11 Dec 2025, 22:38:24 UTC 11 Dec 2025, 22:45:42 UTC Error while computing 118.14 15.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580799 612198 11 Dec 2025, 22:45:46 UTC 12 Dec 2025, 4:01:35 UTC Error while computing 238.22 31.58 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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