Workunit 31577383

name cdk8_A25_A18_r0_1-QUICO_ATM_GAFF2_NAGL_cdk8-0-6-RND4358
application ATM: Free energy calculations of protein-ligand binding
created 24 Apr 2026, 11:50:23 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
38627396 640476 24 Apr 2026, 12:09:09 UTC 24 Apr 2026, 12:14:25 UTC Error while computing 43.38 7.16 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38627541 648092 24 Apr 2026, 12:19:40 UTC 24 Apr 2026, 12:19:56 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38627567 629717 24 Apr 2026, 12:22:11 UTC 24 Apr 2026, 15:24:37 UTC Error while computing 102.70 15.27 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38628048 638898 24 Apr 2026, 15:24:45 UTC 25 Apr 2026, 11:21:24 UTC Error while computing 50.78 4.58 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38630214 650299 25 Apr 2026, 11:21:30 UTC 25 Apr 2026, 11:25:08 UTC Error while computing 90.60 12.78 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38630224 549890 25 Apr 2026, 11:25:23 UTC 30 Apr 2026, 11:25:23 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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