Workunit 31545070

name JNK1_A24_A14_r4_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND4701
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:18:28 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
38579745 628351 11 Dec 2025, 13:18:33 UTC 11 Dec 2025, 13:48:38 UTC Error while computing 68.23 18.71 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580089 639537 11 Dec 2025, 13:48:46 UTC 11 Dec 2025, 13:56:39 UTC Error while computing 93.74 16.14 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580135 637171 11 Dec 2025, 13:56:43 UTC 11 Dec 2025, 14:02:27 UTC Error while computing 42.67 1.13 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580164 611154 11 Dec 2025, 14:02:34 UTC 11 Dec 2025, 14:04:31 UTC Error while computing 51.92 3.76 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580175 594224 11 Dec 2025, 14:04:38 UTC 11 Dec 2025, 14:09:12 UTC Error while computing 230.64 31.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580198 632144 11 Dec 2025, 14:09:22 UTC 11 Dec 2025, 14:12:38 UTC Error while computing 65.57 1.89 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580216 609955 11 Dec 2025, 14:12:45 UTC 11 Dec 2025, 14:17:39 UTC Error while computing 165.66 14.80 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580235 630876 11 Dec 2025, 14:17:46 UTC 12 Dec 2025, 5:04:54 UTC Error while computing 101.99 17.39 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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