Workunit 31545006

name JNK1_A10_A05_r0_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND4025
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:12:24 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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38579652 637607 11 Dec 2025, 13:12:32 UTC 11 Dec 2025, 13:22:29 UTC Error while computing 124.90 33.65 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579833 611154 11 Dec 2025, 13:22:32 UTC 11 Dec 2025, 13:25:22 UTC Error while computing 48.44 5.68 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579881 646864 11 Dec 2025, 13:25:28 UTC 11 Dec 2025, 14:08:10 UTC Error while computing 139.79 18.25 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580194 631624 11 Dec 2025, 14:08:19 UTC 11 Dec 2025, 14:11:53 UTC Error while computing 86.98 6.69 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580210 646363 11 Dec 2025, 14:11:59 UTC 11 Dec 2025, 14:23:06 UTC Error while computing 127.80 29.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580251 594224 11 Dec 2025, 14:23:09 UTC 11 Dec 2025, 14:27:36 UTC Error while computing 234.23 30.11 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580328 523675 11 Dec 2025, 14:27:39 UTC 11 Dec 2025, 19:15:01 UTC Error while computing 51.32 11.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580727 615690 11 Dec 2025, 19:15:11 UTC 11 Dec 2025, 19:20:46 UTC Error while computing 223.68 25.91 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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