Workunit 31553398

name p38_A27_A32_r0_5-QUICO_ATM_GAFF2_NAGL_p38-0-6-RND1400
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:52:17 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
38597506 643393 8 Apr 2026, 8:17:28 UTC 8 Apr 2026, 8:37:57 UTC Error while computing 212.48 2.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38597978 505468 8 Apr 2026, 8:44:48 UTC 8 Apr 2026, 9:04:00 UTC Abandoned 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598166 620419 8 Apr 2026, 9:12:25 UTC 8 Apr 2026, 9:40:29 UTC Error while computing 167.95 7.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598393 593958 8 Apr 2026, 9:43:42 UTC 8 Apr 2026, 9:48:08 UTC Error while computing 116.96 0.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598430 646239 8 Apr 2026, 9:48:48 UTC 8 Apr 2026, 9:51:36 UTC Error while computing 61.51 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598443 545947 8 Apr 2026, 9:52:08 UTC 8 Apr 2026, 9:58:29 UTC Error while computing 190.56 8.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598473 631655 8 Apr 2026, 9:58:40 UTC 8 Apr 2026, 12:24:14 UTC Error while computing 83.92 0.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598800 637796 8 Apr 2026, 12:24:23 UTC 8 Apr 2026, 13:09:36 UTC Error while computing 52.69 0.49 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598897 651855 8 Apr 2026, 13:09:44 UTC 8 Apr 2026, 20:23:26 UTC Error while computing 69.41 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


©2026 Universitat Pompeu Fabra