Workunit 31552487

name BACE_A05_A03_r0_3-QUICO_ATM_GAFF2_NAGL_BACE-0-6-RND0599
application ATM: Free energy calculations of protein-ligand binding
created 8 Apr 2026, 7:26:48 UTC
canonical result 38598921
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
38596535 505468 8 Apr 2026, 7:26:54 UTC 8 Apr 2026, 7:32:40 UTC Error while computing 184.45 3.20 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38596702 629623 8 Apr 2026, 7:37:33 UTC 8 Apr 2026, 13:11:02 UTC Aborted 18,692.33 18,692.33 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598901 651820 8 Apr 2026, 13:11:36 UTC 8 Apr 2026, 13:17:28 UTC Error while computing 76.80 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38598921 642776 8 Apr 2026, 13:17:37 UTC 8 Apr 2026, 18:20:27 UTC Completed and validated 18,071.57 16,419.91 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


©2026 Universitat Pompeu Fabra