Task 38641496
| Name | tnks2_A04_A22_r0_1-QUICO_ATM_OpenFF23_NAGL_tnks2-4-6-RND7174_0 |
| Workunit | 31588665 |
| Created | 2 May 2026, 18:52:35 UTC |
| Sent | 2 May 2026, 18:52:40 UTC |
| Report deadline | 7 May 2026, 18:52:40 UTC |
| Received | 2 May 2026, 19:49:03 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Aborted by user |
| Exit status | 203 (0x000000CB) EXIT_ABORTED_VIA_GUI |
| Computer ID | 632099 |
| Run time | |
| CPU time | |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 30,034.22 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
Stderr output
<core_client_version>8.0.2</core_client_version> <![CDATA[ <message> aborted by user</message> ]]>
©2026 Universitat Pompeu Fabra