Workunit 31553084

name p38_A04_A14_r0_3-QUICO_ATM_GAFF2_NAGL_p38-0-6-RND1016
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:43:12 UTC
canonical result 38598463
granted credit 750,000.00
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
Task
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StatusRun time
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CPU time
(sec)
CreditApplication
38597169 645421 8 Apr 2026, 7:56:02 UTC 8 Apr 2026, 8:03:23 UTC Error while computing 324.02 228.83 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38597813 643393 8 Apr 2026, 8:37:57 UTC 8 Apr 2026, 9:08:54 UTC Error while computing 233.45 17.47 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598233 489629 8 Apr 2026, 9:14:41 UTC 8 Apr 2026, 9:19:11 UTC Error while computing 152.33 0.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598301 646239 8 Apr 2026, 9:23:38 UTC 8 Apr 2026, 9:26:27 UTC Error while computing 61.50 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598331 565740 8 Apr 2026, 9:27:23 UTC 8 Apr 2026, 9:36:50 UTC Error while computing 264.36 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598376 617857 8 Apr 2026, 9:43:32 UTC 8 Apr 2026, 9:50:38 UTC Error while computing 130.04 0.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598442 593958 8 Apr 2026, 9:51:37 UTC 8 Apr 2026, 9:56:08 UTC Error while computing 98.11 0.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598463 650109 8 Apr 2026, 9:57:28 UTC 8 Apr 2026, 18:52:42 UTC Completed and validated 14,258.17 14,258.17 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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