Workunit 31586954

name shp2_A20_A10_r0_3-QUICO_ATM_GAFF2_NAGL_shp2-4-6-RND7181
application ATM: Free energy calculations of protein-ligand binding
created 30 Apr 2026, 18:26:12 UTC
canonical result 38642045
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
38639383 574909 30 Apr 2026, 18:26:19 UTC 4 May 2026, 11:18:35 UTC Error while computing 89,837.05 88,680.59 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38642045 629206 4 May 2026, 11:18:41 UTC 9 May 2026, 11:37:47 UTC Completed and validated 45,897.78 45,897.78 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38644748 641115 9 May 2026, 11:18:45 UTC 14 May 2026, 11:18:45 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


©2026 Universitat Pompeu Fabra