Workunit 31544993

name JNK1_A01_A04_r2_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND2200
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:11:10 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
38579639 618719 11 Dec 2025, 13:11:18 UTC 11 Dec 2025, 13:18:31 UTC Error while computing 342.10 38.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579746 521288 11 Dec 2025, 13:18:37 UTC 11 Dec 2025, 13:21:31 UTC Error while computing 86.64 9.17 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579807 631745 11 Dec 2025, 13:21:37 UTC 11 Dec 2025, 14:01:32 UTC Error while computing 775.30 775.30 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580159 484079 11 Dec 2025, 14:01:41 UTC 11 Dec 2025, 14:21:50 UTC Error while computing 215.71 20.31 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580247 626120 11 Dec 2025, 14:21:54 UTC 11 Dec 2025, 14:25:36 UTC Error while computing 97.46 12.45 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580294 627682 11 Dec 2025, 14:25:39 UTC 11 Dec 2025, 20:49:15 UTC Error while computing 97.29 12.48 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580752 625602 11 Dec 2025, 20:49:24 UTC 11 Dec 2025, 20:51:23 UTC Error while computing 81.42 18.11 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580754 605310 11 Dec 2025, 20:51:27 UTC 12 Dec 2025, 1:16:54 UTC Error while computing 32.56 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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