Workunit 31586787

name shp2_A09_A08_r0_4-QUICO_ATM_GAFF2_NAGL_shp2-4-6-RND1667
application ATM: Free energy calculations of protein-ligand binding
created 30 Apr 2026, 15:17:30 UTC
canonical result 38640164
granted credit 750,000.00
minimum quorum 1
initial replication 1
max # of error/total/success tasks 7, 10, 6
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38639156 649987 30 Apr 2026, 15:17:45 UTC 1 May 2026, 8:53:26 UTC Error while computing 92.74 33.58 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38640164 651954 1 May 2026, 8:53:32 UTC 2 May 2026, 8:18:38 UTC Completed and validated 28,930.21 28,930.21 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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