Workunit 31545034

name JNK1_A20_A01_r3_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND4322
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:15:05 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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CreditApplication
38579683 596137 11 Dec 2025, 13:15:14 UTC 11 Dec 2025, 13:24:56 UTC Error while computing 152.79 17.77 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579870 612458 11 Dec 2025, 13:24:57 UTC 11 Dec 2025, 13:48:10 UTC Error while computing 1,150.79 1.59 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580084 611154 11 Dec 2025, 13:48:23 UTC 11 Dec 2025, 13:49:46 UTC Error while computing 48.62 6.37 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580093 621366 11 Dec 2025, 13:49:53 UTC 11 Dec 2025, 14:00:11 UTC Error while computing 58.87 5.68 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580150 637171 11 Dec 2025, 14:00:21 UTC 11 Dec 2025, 14:03:26 UTC Error while computing 61.30 4.60 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580167 633196 11 Dec 2025, 14:03:36 UTC 11 Dec 2025, 14:07:51 UTC Error while computing 87.36 14.56 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580189 642464 11 Dec 2025, 14:07:59 UTC 11 Dec 2025, 14:45:31 UTC Error while computing 73.51 14.45 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580450 647027 11 Dec 2025, 14:45:42 UTC 11 Dec 2025, 14:57:35 UTC Error while computing 187.34 14.13 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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