Workunit 31585450

name shp2_A14_A09_r0_3-QUICO_ATM_GAFF2_NAGL_shp2-2-6-RND7236
application ATM: Free energy calculations of protein-ligand binding
created 29 Apr 2026, 16:09:24 UTC
canonical result 38638652
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
38637438 649987 29 Apr 2026, 16:09:42 UTC 30 Apr 2026, 8:59:17 UTC Error while computing 16,492.50 16,492.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38638652 591716 30 Apr 2026, 8:59:27 UTC 1 May 2026, 18:43:01 UTC Completed and validated 39,207.91 33,609.64 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


©2026 Universitat Pompeu Fabra