Workunit 31589768

name shp2_A26_A19_r0_4-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND2569
application ATM: Free energy calculations of protein-ligand binding
created 7 May 2026, 10:49:39 UTC
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
Task
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ComputerSentTime reported
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StatusRun time
(sec)
CPU time
(sec)
CreditApplication
38643156 585486 7 May 2026, 10:50:28 UTC 8 May 2026, 4:28:05 UTC Error while computing 2,977.89 2,806.47 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644109 472232 8 May 2026, 4:28:08 UTC 8 May 2026, 9:21:08 UTC Error while computing 17,479.53 17,450.36 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644250 604216 8 May 2026, 9:21:15 UTC 9 May 2026, 2:11:49 UTC Error while computing 15,418.49 15,266.80 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644623 651233 9 May 2026, 2:11:53 UTC 9 May 2026, 12:07:00 UTC Error while computing 35,707.00 35,975.81 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644756 485535 9 May 2026, 12:07:07 UTC 9 May 2026, 12:42:01 UTC Error while computing 265.40 141.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644762 649650 9 May 2026, 12:42:08 UTC 9 May 2026, 12:42:24 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644763 618719 9 May 2026, 12:42:28 UTC 9 May 2026, 20:44:33 UTC Error while computing 27,516.31 26,327.86 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644820 652207 9 May 2026, 20:44:41 UTC 14 May 2026, 20:44:41 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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