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| Name | Last modified | Size | Description |
|---|---|---|---|---|
| Parent Directory | - | ||
| q_1aopt.mol | 2026-05-20 20:47 | 2.2K | |
| q_1aopt.mol2 | 2026-05-20 20:48 | 2.4K | |
| out.txt | 2026-05-20 20:48 | 380 | |
| mol2/ | 2026-05-20 20:48 | - | |
| lbs_all_temp.log | 2026-05-20 20:48 | 54 | |
| out_all.txt | 2026-05-20 20:48 | 1.0K | |
| xlogp1.txt | 2026-05-20 20:48 | 496 | |
| xlogp2.txt | 2026-05-20 20:48 | 67 | |
| py_error | 2026-05-20 20:48 | 3.8K | |
| q_1aopt.svg | 2026-05-20 20:48 | 3.0K | |
| DB03255-super.mol2 | 2026-05-20 20:48 | 938 | |
| DB00120-super.mol2 | 2026-05-20 20:48 | 1.6K | |
| DB02266-super.mol2 | 2026-05-20 20:48 | 2.3K | |
| DB01121-super.mol2 | 2026-05-20 20:48 | 1.7K | |
| DB14191-super.mol2 | 2026-05-20 20:48 | 2.0K | |
| DB04657-super.mol2 | 2026-05-20 20:48 | 1.8K | |
| DB09355-super.mol2 | 2026-05-20 20:48 | 2.3K | |
| DB13218-super.mol2 | 2026-05-20 20:48 | 1.4K | |
| DB11071-super.mol2 | 2026-05-20 20:48 | 1.8K | |
| DB02546-super.mol2 | 2026-05-20 20:48 | 2.2K | |
| DB01247-super.mol2 | 2026-05-20 20:48 | 2.0K | |
| DB00643-super.mol2 | 2026-05-20 20:48 | 2.5K | |
| DB12537-super.mol2 | 2026-05-20 20:48 | 1.3K | |
| DB14020-super.mol2 | 2026-05-20 20:48 | 1.8K | |
| DB14195-super.mol2 | 2026-05-20 20:48 | 2.0K | |
| DB05015-super.mol2 | 2026-05-20 20:48 | 2.6K | |
| DB09269-super.mol2 | 2026-05-20 20:48 | 1.2K | |
| DB11989-super.mol2 | 2026-05-20 20:48 | 2.1K | |
| DB03793-super.mol2 | 2026-05-20 20:48 | 1.1K | |
| DB00554-super.mol2 | 2026-05-20 20:48 | 2.6K | |
| q_1aopt-20260520144759.tar.gz | 2026-05-20 20:48 | 1.8K | |
| status.txt | 2026-05-20 20:48 | 4 | |
| err | 2026-05-20 20:48 | 323 | |
| log | 2026-05-20 20:48 | 54 | |
| py_log | 2026-05-20 20:48 | 21K | |