| Name | Last modified | Size | Description | |
|---|---|---|---|---|
| Parent Directory | - | |||
| mol2/ | 2026-04-01 15:04 | - | ||
| status.txt | 2026-04-01 15:11 | 4 | ||
| log | 2026-04-01 15:11 | 54 | ||
| lbs_all_temp.log | 2026-04-01 15:08 | 57 | ||
| xlogp2.txt | 2026-04-01 15:08 | 97 | ||
| err | 2026-04-01 15:11 | 323 | ||
| xlogp1.txt | 2026-04-01 15:08 | 526 | ||
| out.txt | 2026-04-01 15:04 | 931 | ||
| out_all.txt | 2026-04-01 15:08 | 2.3K | ||
| DB00715-super.mol2 | 2026-04-01 15:10 | 2.6K | ||
| DB00768-super.mol2 | 2026-04-01 15:11 | 2.7K | ||
| DB01608-super.mol2 | 2026-04-01 15:10 | 2.8K | ||
| DB00693-super.mol2 | 2026-04-01 15:09 | 2.8K | ||
| DB00843-super.mol2 | 2026-04-01 15:09 | 2.9K | ||
| DB00737-super.mol2 | 2026-04-01 15:10 | 2.9K | ||
| DB01148-super.mol2 | 2026-04-01 15:10 | 3.0K | ||
| DB00820-super.mol2 | 2026-04-01 15:11 | 3.1K | ||
| DB11978-super.mol2 | 2026-04-01 15:10 | 3.2K | ||
| DB13520-super.mol2 | 2026-04-01 15:09 | 3.2K | ||
| DB00317-super.mol2 | 2026-04-01 15:09 | 3.3K | ||
| DB12612-super.mol2 | 2026-04-01 15:10 | 3.3K | ||
| DB00210-super.mol2 | 2026-04-01 15:09 | 3.3K | ||
| DB09101-super.mol2 | 2026-04-01 15:08 | 3.3K | ||
| DB09094-super.mol2 | 2026-04-01 15:09 | 3.4K | ||
| DB11827-super.mol2 | 2026-04-01 15:08 | 3.4K | ||
| DB06212-super.mol2 | 2026-04-01 15:10 | 3.4K | ||
| DB00496-super.mol2 | 2026-04-01 15:11 | 3.5K | ||
| DB00604-super.mol2 | 2026-04-01 15:10 | 3.5K | ||
| DB00590-super.mol2 | 2026-04-01 15:09 | 3.6K | ||
| DB09280-super.mol2 | 2026-04-01 15:08 | 3.6K | ||
| DB06249-super.mol2 | 2026-04-01 15:09 | 3.6K | ||
| DB12808-super.mol2 | 2026-04-01 15:09 | 3.6K | ||
| DB06210-super.mol2 | 2026-04-01 15:10 | 3.6K | ||
| DB09143-super.mol2 | 2026-04-01 15:09 | 3.6K | ||
| DB00275-super.mol2 | 2026-04-01 15:10 | 3.6K | ||
| DB06684-super.mol2 | 2026-04-01 15:08 | 3.7K | ||
| DB00481-super.mol2 | 2026-04-01 15:10 | 3.7K | ||
| DB01003-super.mol2 | 2026-04-01 15:10 | 3.7K | ||
| DB06401-super.mol2 | 2026-04-01 15:10 | 3.8K | ||
| DB12371-super.mol2 | 2026-04-01 15:09 | 3.8K | ||
| DB15685-super.mol2 | 2026-04-01 15:10 | 4.1K | ||
| DB00966-super.mol2 | 2026-04-01 15:10 | 4.1K | ||
| DB11828-super.mol2 | 2026-04-01 15:10 | 4.2K | ||
| DB12070-super.mol2 | 2026-04-01 15:08 | 4.2K | ||
| DB14568-super.mol2 | 2026-04-01 15:09 | 4.2K | ||
| DB01259-super.mol2 | 2026-04-01 15:11 | 4.2K | ||
| q_Conformer3D_COMPOUND_CID_118434635-20260401123418.tar.gz | 2026-04-01 15:11 | 4.2K | ||
| DB00471-super.mol2 | 2026-04-01 15:09 | 4.3K | ||
| DB00549-super.mol2 | 2026-04-01 15:08 | 4.3K | ||
| DB11611-super.mol2 | 2026-04-01 15:10 | 4.3K | ||
| DB08822-super.mol2 | 2026-04-01 15:09 | 4.3K | ||
| DB12887-super.mol2 | 2026-04-01 15:10 | 4.4K | ||
| DB00796-super.mol2 | 2026-04-01 15:09 | 4.6K | ||
| DB11979-super.mol2 | 2026-04-01 15:10 | 4.7K | ||
| DB01199-super.mol2 | 2026-04-01 15:10 | 4.7K | ||
| DB00224-super.mol2 | 2026-04-01 15:10 | 4.9K | ||
| DB06636-super.mol2 | 2026-04-01 15:10 | 5.3K | ||
| DB11581-super.mol2 | 2026-04-01 15:09 | 6.4K | ||
| DB11613-super.mol2 | 2026-04-01 15:11 | 6.9K | ||
| q_Conformer3D_COMPOUND_CID_118434635.mol | 2026-04-01 15:04 | 7.3K | ||
| py_error | 2026-04-01 15:08 | 7.4K | ||
| q_Conformer3D_COMPOUND_CID_118434635.mol2 | 2026-04-01 15:04 | 8.0K | ||
| q_Conformer3D_COMPOUND_CID_118434635.svg | 2026-04-01 15:08 | 8.8K | ||
| q_Conformer3D_COMPOUND_CID_118434635.sdf | 2026-04-01 15:02 | 10K | ||
| py_log | 2026-04-01 15:11 | 52K | ||