Workunit 31553196

name MCL1_A37_A32_r0_1-QUICO_ATM_GAFF2_NAGL_MCL1-0-6-RND8146
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:45:22 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
38597293 629467 8 Apr 2026, 8:03:54 UTC 8 Apr 2026, 8:21:31 UTC Error while computing 936.53 647.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38597903 643393 8 Apr 2026, 8:42:38 UTC 8 Apr 2026, 9:08:54 UTC Error while computing 205.07 4.55 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598235 593958 8 Apr 2026, 9:20:26 UTC 8 Apr 2026, 9:24:28 UTC Error while computing 105.59 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598323 598432 8 Apr 2026, 9:30:53 UTC 8 Apr 2026, 9:37:41 UTC Error while computing 89.01 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598382 646239 8 Apr 2026, 9:37:51 UTC 8 Apr 2026, 9:40:20 UTC Error while computing 58.45 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598392 648465 8 Apr 2026, 9:41:46 UTC 8 Apr 2026, 9:45:49 UTC Error while computing 51.15 7.76 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598419 617857 8 Apr 2026, 9:47:38 UTC 8 Apr 2026, 9:54:49 UTC Error while computing 127.01 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598459 568231 8 Apr 2026, 9:55:31 UTC 13 Apr 2026, 9:55:31 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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