Workunit 31553375

name p38_A27_A25_r0_2-QUICO_ATM_GAFF2_NAGL_p38-0-6-RND9849
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:51:26 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
38597482 617857 8 Apr 2026, 8:12:58 UTC 8 Apr 2026, 8:20:38 UTC Error while computing 101.91 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38597900 637325 8 Apr 2026, 8:45:10 UTC 9 Apr 2026, 5:27:04 UTC Error while computing 122.08 0.22 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38600631 651330 9 Apr 2026, 5:27:14 UTC 9 Apr 2026, 7:13:23 UTC Error while computing 20.55 0.10 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38600788 518555 9 Apr 2026, 7:13:44 UTC 9 Apr 2026, 9:01:07 UTC Error while computing 76.80 0.45 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38600967 649650 9 Apr 2026, 9:01:09 UTC 9 Apr 2026, 9:01:43 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38600968 606121 9 Apr 2026, 9:01:50 UTC 9 Apr 2026, 13:01:27 UTC Error while computing 150.96 1.89 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38601381 651884 9 Apr 2026, 13:01:40 UTC 9 Apr 2026, 13:09:02 UTC Error while computing 46.75 0.32 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601394 637038 9 Apr 2026, 13:09:13 UTC 9 Apr 2026, 13:15:10 UTC Error while computing 37.87 0.25 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601401 642631 9 Apr 2026, 13:15:20 UTC 14 Apr 2026, 13:15:20 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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