Workunit 31545026

name JNK1_A19_A34_r0_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND4850
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:14:20 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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38579675 457130 11 Dec 2025, 13:14:28 UTC 11 Dec 2025, 13:30:06 UTC Error while computing 153.09 17.17 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579934 594224 11 Dec 2025, 13:30:13 UTC 11 Dec 2025, 13:34:52 UTC Error while computing 241.08 26.45 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579977 611154 11 Dec 2025, 13:35:04 UTC 11 Dec 2025, 13:39:38 UTC Error while computing 74.00 2.99 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580014 596137 11 Dec 2025, 13:39:51 UTC 11 Dec 2025, 13:45:37 UTC Error while computing 150.59 21.66 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580062 605313 11 Dec 2025, 13:45:45 UTC 11 Dec 2025, 13:56:20 UTC Error while computing 76.82 14.94 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580134 503617 11 Dec 2025, 13:56:28 UTC 11 Dec 2025, 13:59:12 UTC Error while computing 85.73 23.83 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580146 549309 11 Dec 2025, 13:59:19 UTC 11 Dec 2025, 14:53:14 UTC Error while computing 71.33 18.17 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580460 640564 11 Dec 2025, 14:53:20 UTC 11 Dec 2025, 16:50:58 UTC Error while computing 33.72 33.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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