Workunit 31545107

name JNK1_A30_A37_r1_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND3236
application ATM: Free energy calculations of protein-ligand binding
created 11 Dec 2025, 13:21:50 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
38579814 637171 11 Dec 2025, 13:21:53 UTC 11 Dec 2025, 13:27:48 UTC Error while computing 46.98 10.73 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579915 637154 11 Dec 2025, 13:27:53 UTC 16 Dec 2025, 12:42:21 UTC Error while computing 323.70 16.95 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38584058 618710 16 Dec 2025, 12:42:32 UTC 16 Dec 2025, 13:02:29 UTC Error while computing 917.79 123.61 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38584069 625330 16 Dec 2025, 13:02:39 UTC 16 Dec 2025, 14:08:46 UTC Error while computing 220.39 56.14 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38584135 629195 16 Dec 2025, 14:08:59 UTC 16 Dec 2025, 14:57:50 UTC Abandoned 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38584197 515340 16 Dec 2025, 14:57:59 UTC 16 Dec 2025, 15:01:28 UTC Error while computing 95.80 16.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38584198 612198 16 Dec 2025, 15:01:31 UTC 16 Dec 2025, 15:45:10 UTC Error while computing 171.70 15.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38584202 641764 16 Dec 2025, 15:45:11 UTC 16 Dec 2025, 16:01:59 UTC Error while computing 75.04 15.95 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38584205 644236 16 Dec 2025, 16:02:09 UTC 16 Dec 2025, 16:40:22 UTC Error while computing 228.08 80.95 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


©2025 Universitat Pompeu Fabra