Workunit 31553623

name PTP1B_A18_A03_r0_5-QUICO_ATM_GAFF2_NAGL_PTP1B-0-6-RND6886
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:59:41 UTC
canonical result 38598460
granted credit 750,000.00
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
Task
click for details
ComputerSentTime reported
or deadline
explain
StatusRun time
(sec)
CPU time
(sec)
CreditApplication
38597751 505468 8 Apr 2026, 8:31:40 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
38598184 648465 8 Apr 2026, 9:07:44 UTC 8 Apr 2026, 9:11:29 UTC Error while computing 56.58 17.20 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598258 643393 8 Apr 2026, 9:18:53 UTC 8 Apr 2026, 9:28:22 UTC Error while computing 222.07 13.56 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598342 646239 8 Apr 2026, 9:46:27 UTC 8 Apr 2026, 9:48:48 UTC Error while computing 58.47 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598431 619836 8 Apr 2026, 9:49:35 UTC 8 Apr 2026, 9:52:27 UTC Error while computing 77.70 0.03 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598445 442069 8 Apr 2026, 9:52:47 UTC 8 Apr 2026, 9:55:48 UTC Error while computing 74.56 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598460 651756 8 Apr 2026, 9:55:55 UTC 9 Apr 2026, 8:00:35 UTC Completed and validated 27,871.78 23,926.19 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


©2026 Universitat Pompeu Fabra