Task 38644687
| Name | shp2_A22_A13_r0_1-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND4698_7 |
| Workunit | 31589745 |
| Created | 9 May 2026, 6:45:37 UTC |
| Sent | 9 May 2026, 6:45:40 UTC |
| Report deadline | 14 May 2026, 6:45:40 UTC |
| Received | 9 May 2026, 7:21:16 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Aborted by user |
| Exit status | 203 (0x000000CB) EXIT_ABORTED_VIA_GUI |
| Computer ID | 611154 |
| Run time | |
| CPU time | |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 49,330.48 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
Stderr output
<core_client_version>8.2.8</core_client_version> <![CDATA[ <message> aborted by user</message> ]]>
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