Workunit 31545073

name JNK1_A24_A37_r2_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND0961
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:18:44 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
38579750 609323 11 Dec 2025, 13:18:47 UTC 11 Dec 2025, 13:22:15 UTC Error while computing 98.92 43.16 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579824 526681 11 Dec 2025, 13:22:23 UTC 11 Dec 2025, 13:32:58 UTC Error while computing 355.49 71.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38579960 645087 11 Dec 2025, 13:33:08 UTC 11 Dec 2025, 13:44:36 UTC Error while computing 55.65 15.92 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580052 512671 11 Dec 2025, 13:44:43 UTC 11 Dec 2025, 13:53:16 UTC Error while computing 131.81 17.05 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580118 637171 11 Dec 2025, 13:53:24 UTC 11 Dec 2025, 14:00:21 UTC Error while computing 42.58 1.26 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580152 621366 11 Dec 2025, 14:00:28 UTC 11 Dec 2025, 14:07:55 UTC Error while computing 55.37 6.65 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580191 124372 11 Dec 2025, 14:08:05 UTC 11 Dec 2025, 17:22:35 UTC Error while computing 0.94 0.94 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580710 647736 11 Dec 2025, 17:22:38 UTC 13 Dec 2025, 15:40:26 UTC Error while computing 42.43 3.69 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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