Workunit 31589767

name shp2_A26_A19_r0_3-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND8717
application ATM: Free energy calculations of protein-ligand binding
created 7 May 2026, 10:49:35 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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StatusRun time
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CPU time
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CreditApplication
38643155 585486 7 May 2026, 10:50:08 UTC 8 May 2026, 3:37:31 UTC Error while computing 1,883.42 1,791.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644091 649650 8 May 2026, 3:37:37 UTC 8 May 2026, 9:11:12 UTC Error while computing 3,072.50 3,072.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644243 647736 8 May 2026, 9:11:18 UTC 8 May 2026, 22:58:20 UTC Error while computing 781.19 732.01 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644577 580989 8 May 2026, 22:58:28 UTC 9 May 2026, 7:55:57 UTC Error while computing 979.03 908.31 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644702 610902 9 May 2026, 7:56:02 UTC 10 May 2026, 12:25:34 UTC Error while computing 1,460.49 980.09 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644906 651372 10 May 2026, 12:25:46 UTC 11 May 2026, 13:22:45 UTC Error while computing 70.37 0.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644997 540129 11 May 2026, 13:22:50 UTC 11 May 2026, 15:55:48 UTC Error while computing 9,094.46 8,675.09 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38645013 632144 11 May 2026, 15:55:52 UTC 11 May 2026, 16:40:22 UTC Error while computing 1,596.14 1,548.17 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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