Task 38608368
| Name | MCL1_A28_A25_r0_1-QUICO_ATM_OpenFF_MCL1-2-6-RND4258_0 |
| Workunit | 31561722 |
| Created | 14 Apr 2026, 15:47:00 UTC |
| Sent | 14 Apr 2026, 15:47:13 UTC |
| Report deadline | 19 Apr 2026, 15:47:13 UTC |
| Received | 14 Apr 2026, 15:50:54 UTC |
| Server state | Over |
| Outcome | Computation error |
| Client state | Compute error |
| Exit status | 1 (0x00000001) Unknown error code |
| Computer ID | 535175 |
| Run time | 1 min 45 sec |
| CPU time | |
| Validate state | Invalid |
| Credit | 0.00 |
| Device peak FLOPS | 11,344.04 GFLOPS |
| Application version | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| Peak working set size | 11.25 MB |
| Peak swap size | 6.22 MB |
| Peak disk usage | 1.54 GB |
Stderr output
<core_client_version>7.20.2</core_client_version> <![CDATA[ <message> Incorrect function. (0x1) - exit code 1 (0x1)</message> ]]>
©2026 Universitat Pompeu Fabra