Workunit 31545032

name JNK1_A20_A01_r1_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND9781
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:14:54 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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38579681 625581 11 Dec 2025, 13:15:05 UTC 11 Dec 2025, 13:22:28 UTC Error while computing 61.83 21.19 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579831 611154 11 Dec 2025, 13:22:32 UTC 11 Dec 2025, 13:26:34 UTC Error while computing 54.62 1.55 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579895 618582 11 Dec 2025, 13:26:37 UTC 11 Dec 2025, 13:33:59 UTC Error while computing 108.97 19.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579971 635604 11 Dec 2025, 13:34:08 UTC 11 Dec 2025, 13:35:51 UTC Error while computing 74.92 20.79 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579990 590877 11 Dec 2025, 13:35:59 UTC 11 Dec 2025, 13:49:54 UTC Error while computing 121.42 19.77 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580094 595174 11 Dec 2025, 13:50:04 UTC 11 Dec 2025, 14:03:49 UTC Error while computing 46.25 9.40 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580170 601928 11 Dec 2025, 14:03:53 UTC 11 Dec 2025, 14:12:57 UTC Error while computing 79.87 18.14 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580218 549691 11 Dec 2025, 14:13:05 UTC 11 Dec 2025, 23:11:23 UTC Error while computing 40.22 5.31 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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