Workunit 31585199

name tnks2_A02_A26_r0_4-QUICO_ATM_OpenFF23_NAGL_tnks2-0-6-RND2513
application ATM: Free energy calculations of protein-ligand binding
created 29 Apr 2026, 14:19:19 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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CreditApplication
38637124 648946 29 Apr 2026, 14:20:49 UTC 29 Apr 2026, 21:15:37 UTC Error while computing 95.10 21.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38637818 610949 29 Apr 2026, 21:15:44 UTC 29 Apr 2026, 21:19:49 UTC Error while computing 154.97 50.17 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38637829 610880 29 Apr 2026, 21:19:57 UTC 30 Apr 2026, 20:10:28 UTC Error while computing 268.32 167.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38639477 646098 30 Apr 2026, 20:10:37 UTC 30 Apr 2026, 23:58:54 UTC Error while computing 238.53 110.73 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38639703 563109 30 Apr 2026, 23:59:11 UTC 2 May 2026, 1:54:41 UTC Error while computing 242.65 47.86 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38640934 478420 2 May 2026, 1:55:02 UTC 2 May 2026, 2:00:28 UTC Error while computing 203.22 27.45 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38640939 638290 2 May 2026, 2:00:43 UTC 2 May 2026, 2:03:42 UTC Error while computing 95.98 29.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38640942 618086 2 May 2026, 2:03:56 UTC 3 May 2026, 9:31:19 UTC Error while computing 168.16 54.98 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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