Workunit 31545062

name JNK1_A21_A33_r1_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND2653
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:17:46 UTC
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
errors Too many errors (may have bug) Too many total results
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StatusRun time
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CPU time
(sec)
CreditApplication
38579731 644627 11 Dec 2025, 13:17:55 UTC 11 Dec 2025, 13:46:35 UTC Error while computing 234.75 10.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580071 637469 11 Dec 2025, 13:46:43 UTC 11 Dec 2025, 13:51:26 UTC Error while computing 62.60 5.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580105 637171 11 Dec 2025, 13:51:35 UTC 11 Dec 2025, 13:57:14 UTC Error while computing 43.90 1.69 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580137 642593 11 Dec 2025, 13:57:19 UTC 14 Dec 2025, 18:44:12 UTC Error while computing 103.48 12.19 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583824 625602 14 Dec 2025, 18:44:19 UTC 14 Dec 2025, 18:47:43 UTC Error while computing 72.26 11.27 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583827 648094 14 Dec 2025, 18:47:51 UTC 14 Dec 2025, 19:47:30 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583850 643413 14 Dec 2025, 19:47:34 UTC 14 Dec 2025, 23:34:35 UTC Error while computing 126.56 21.34 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583935 635639 14 Dec 2025, 23:34:46 UTC 15 Dec 2025, 0:55:50 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583974 613630 15 Dec 2025, 0:56:02 UTC 15 Dec 2025, 1:08:11 UTC Error while computing 110.25 9.64 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583976 626244 15 Dec 2025, 1:08:18 UTC 15 Dec 2025, 1:11:49 UTC Error while computing 94.76 25.27 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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