Workunit 31577400

name cdk8_A28_A09_r0_3-QUICO_ATM_GAFF2_NAGL_cdk8-0-6-RND5990
application ATM: Free energy calculations of protein-ligand binding
created 24 Apr 2026, 11:51:47 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
38627415 442069 24 Apr 2026, 12:05:33 UTC 24 Apr 2026, 13:07:26 UTC Error while computing 77.40 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38627743 637639 24 Apr 2026, 13:07:54 UTC 24 Apr 2026, 15:35:47 UTC Error while computing 147.02 0.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38628069 652183 24 Apr 2026, 15:36:30 UTC 24 Apr 2026, 23:25:18 UTC Error while computing 74.51 12.89 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38628928 642513 24 Apr 2026, 23:25:37 UTC 24 Apr 2026, 23:56:03 UTC Error while computing 45.20 8.55 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38628981 651330 24 Apr 2026, 23:56:11 UTC 25 Apr 2026, 2:16:36 UTC Error while computing 24.67 0.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38629237 648223 25 Apr 2026, 2:16:42 UTC 25 Apr 2026, 2:30:58 UTC Error while computing 40.89 9.32 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38629264 629729 25 Apr 2026, 2:31:09 UTC 25 Apr 2026, 19:19:20 UTC Error while computing 29.11 0.56 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38631088 624761 25 Apr 2026, 19:19:56 UTC 25 Apr 2026, 22:57:56 UTC Error while computing 136.69 6.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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