Workunit 31553474

name PTP1B_A04_A17_r0_1-QUICO_ATM_GAFF2_NAGL_PTP1B-0-6-RND5426
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:54:09 UTC
canonical result 38598475
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
38597583 649637 8 Apr 2026, 8:21:56 UTC 8 Apr 2026, 8:28:17 UTC Error while computing 152.30 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38597928 615368 8 Apr 2026, 8:48:51 UTC 8 Apr 2026, 9:15:20 UTC Error while computing 602.55 0.52 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598274 617857 8 Apr 2026, 9:25:18 UTC 8 Apr 2026, 9:33:43 UTC Error while computing 104.86 0.03 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598365 598432 8 Apr 2026, 9:37:42 UTC 8 Apr 2026, 9:45:29 UTC Error while computing 90.96 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598416 648465 8 Apr 2026, 9:50:37 UTC 8 Apr 2026, 9:53:44 UTC Error while computing 53.25 8.51 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598452 593958 8 Apr 2026, 9:53:54 UTC 8 Apr 2026, 9:58:37 UTC Error while computing 88.79 0.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598475 633963 8 Apr 2026, 9:59:08 UTC 9 Apr 2026, 0:31:28 UTC Completed and validated 26,034.88 25,821.08 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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