Workunit 31589710

name shp2_A20_A15_r0_2-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND0318
application ATM: Free energy calculations of protein-ligand binding
created 7 May 2026, 10:44:24 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
38643093 535048 7 May 2026, 10:44:39 UTC 7 May 2026, 12:55:40 UTC Error while computing 7,751.72 7,345.63 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38643362 593616 7 May 2026, 12:55:46 UTC 7 May 2026, 16:38:14 UTC Error while computing 12,501.83 12,501.83 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38643633 602451 7 May 2026, 16:38:24 UTC 7 May 2026, 18:35:40 UTC Error while computing 6,919.60 6,725.25 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38643755 637614 7 May 2026, 18:35:48 UTC 8 May 2026, 0:05:26 UTC Error while computing 14,344.41 14,344.41 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38643969 506550 8 May 2026, 0:05:31 UTC 8 May 2026, 1:09:57 UTC Error while computing 3,502.66 3,502.66 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644013 649650 8 May 2026, 1:10:04 UTC 8 May 2026, 2:25:22 UTC Error while computing 1,667.13 1,667.13 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644058 464555 8 May 2026, 2:25:31 UTC 8 May 2026, 7:22:02 UTC Error while computing 17,791.00 18,081.58 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644195 594083 8 May 2026, 7:22:07 UTC 8 May 2026, 23:48:26 UTC Error while computing 16,005.92 15,999.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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