Workunit 31545078

name JNK1_A25_A31_r2_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND5321
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:19:11 UTC
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
errors Too many errors (may have bug)
Task
click for details
ComputerSentTime reported
or deadline
explain
StatusRun time
(sec)
CPU time
(sec)
CreditApplication
38579761 637171 11 Dec 2025, 13:19:18 UTC 11 Dec 2025, 13:24:43 UTC Error while computing 45.74 11.13 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579864 619252 11 Dec 2025, 13:24:48 UTC 11 Dec 2025, 22:00:12 UTC Error while computing 59.06 5.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580772 630939 11 Dec 2025, 22:00:19 UTC 11 Dec 2025, 22:12:39 UTC Error while computing 64.72 13.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580779 462662 11 Dec 2025, 22:12:44 UTC 11 Dec 2025, 22:15:44 UTC Error while computing 95.69 40.83 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580782 635604 11 Dec 2025, 22:15:49 UTC 11 Dec 2025, 22:18:00 UTC Error while computing 62.60 11.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580784 642483 11 Dec 2025, 22:18:04 UTC 11 Dec 2025, 22:20:31 UTC Error while computing 43.11 2.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580786 569442 11 Dec 2025, 22:20:39 UTC 11 Dec 2025, 22:32:16 UTC Error while computing 73.93 11.22 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580792 632186 11 Dec 2025, 22:32:25 UTC 11 Dec 2025, 22:40:46 UTC Error while computing 268.11 30.61 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


©2025 Universitat Pompeu Fabra