Workunit 31545087

name JNK1_A27_A37_r1_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND0280
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:19:59 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
38579773 646051 11 Dec 2025, 13:20:02 UTC 11 Dec 2025, 14:25:39 UTC Error while computing 301.41 34.30 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580296 637341 11 Dec 2025, 14:25:45 UTC 14 Dec 2025, 1:14:32 UTC Error while computing 90.31 19.27 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583316 608932 14 Dec 2025, 1:14:38 UTC 14 Dec 2025, 7:02:50 UTC Error while computing 65.53 6.61 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583494 637171 14 Dec 2025, 7:03:03 UTC 14 Dec 2025, 15:08:19 UTC Error while computing 57.44 8.29 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583742 635604 14 Dec 2025, 15:08:32 UTC 14 Dec 2025, 15:10:50 UTC Error while computing 72.89 20.87 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583745 636922 14 Dec 2025, 15:10:55 UTC 14 Dec 2025, 15:14:39 UTC Error while computing 108.92 14.98 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583747 639305 14 Dec 2025, 15:14:43 UTC 14 Dec 2025, 15:20:33 UTC Error while computing 50.12 3.87 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583751 614448 14 Dec 2025, 15:20:39 UTC 14 Dec 2025, 15:38:19 UTC Error while computing 558.26 61.28 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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