Workunit 31545084

name JNK1_A25_A38_r3_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND7388
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:19:43 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
38579769 484079 11 Dec 2025, 13:19:48 UTC 11 Dec 2025, 13:39:25 UTC Error while computing 235.81 14.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580013 625989 11 Dec 2025, 13:39:32 UTC 11 Dec 2025, 13:43:32 UTC Error while computing 240.00 5,760.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580044 638240 11 Dec 2025, 13:43:41 UTC 11 Dec 2025, 13:47:16 UTC Error while computing 129.19 22.98 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580079 647736 11 Dec 2025, 13:47:23 UTC 11 Dec 2025, 13:55:19 UTC Error while computing 43.20 3.55 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580125 639765 11 Dec 2025, 13:55:23 UTC 11 Dec 2025, 14:47:48 UTC Error while computing 135.25 11.36 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580454 637171 11 Dec 2025, 14:47:54 UTC 11 Dec 2025, 16:28:09 UTC Error while computing 46.35 6.80 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580679 627914 11 Dec 2025, 16:28:23 UTC 11 Dec 2025, 16:44:36 UTC Error while computing 99.80 8.89 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580695 506550 11 Dec 2025, 16:44:44 UTC 11 Dec 2025, 19:15:19 UTC Error while computing 107.16 16.89 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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