Workunit 31545829

name HIF2A_A02_A43_r0_4-QUICO_ATM_GAFF2_LOMAP_HIF2A-0-5-RND9209
application ATM: Free energy calculations of protein-ligand binding
created 12 Dec 2025, 10:43:51 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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38581303 557889 12 Dec 2025, 10:44:24 UTC 13 Dec 2025, 0:53:14 UTC Error while computing 39.92 0.59 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582287 645994 13 Dec 2025, 0:53:25 UTC 13 Dec 2025, 0:55:56 UTC Error while computing 23.37 0.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582290 609323 13 Dec 2025, 0:56:07 UTC 13 Dec 2025, 12:45:57 UTC Error while computing 52.87 1.30 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582834 643108 13 Dec 2025, 12:46:02 UTC 13 Dec 2025, 13:24:04 UTC Error while computing 58.30 5.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582862 635604 13 Dec 2025, 13:24:10 UTC 13 Dec 2025, 21:45:00 UTC Error while computing 42.22 1.04 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583185 615763 13 Dec 2025, 21:45:10 UTC 13 Dec 2025, 23:04:47 UTC Error while computing 107.65 1.03 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583232 638061 13 Dec 2025, 23:04:52 UTC 14 Dec 2025, 0:05:16 UTC Error while computing 88.63 2.27 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583266 186626 14 Dec 2025, 0:05:28 UTC 14 Dec 2025, 5:33:18 UTC Error while computing 51.27 0.94 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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