Workunit 31553377

name p38_A27_A25_r0_4-QUICO_ATM_GAFF2_NAGL_p38-0-6-RND1436
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:51:30 UTC
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
errors Too many errors (may have bug)
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CreditApplication
38597484 536931 8 Apr 2026, 8:15:41 UTC 8 Apr 2026, 8:20:15 UTC Error while computing 118.14 7.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38597899 643393 8 Apr 2026, 8:42:38 UTC 8 Apr 2026, 9:08:54 UTC Error while computing 197.67 1.95 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598239 633478 8 Apr 2026, 9:24:58 UTC 8 Apr 2026, 13:04:07 UTC Error while computing 79.27 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598881 606440 8 Apr 2026, 13:04:24 UTC 8 Apr 2026, 21:50:45 UTC Error while computing 184.67 5.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38599848 639838 8 Apr 2026, 21:51:00 UTC 8 Apr 2026, 21:59:12 UTC Error while computing 127.12 4.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38599874 651831 8 Apr 2026, 21:59:23 UTC 8 Apr 2026, 22:04:51 UTC Error while computing 98.04 3.53 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38599887 643627 8 Apr 2026, 22:05:04 UTC 9 Apr 2026, 1:18:27 UTC Error while computing 63.20 0.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38600216 629300 9 Apr 2026, 1:18:35 UTC 9 Apr 2026, 6:00:18 UTC Error while computing 66.33 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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