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| Name | Last modified | Size | Description |
|---|---|---|---|---|
| Parent Directory | - | ||
| 3fcq_ligand.smi | 2023-07-04 15:26 | 25 | |
| ligand.smi | 2023-07-04 15:26 | 25 | |
| 3fcq_ligand_protonated.smi | 2023-07-04 15:26 | 28 | |
| ligand_protonated.smi | 2023-07-04 15:26 | 28 | |
| 3fcq_ligand.sdf | 2023-07-04 15:26 | 1.7K | |
| ligand.sdf | 2023-07-04 15:26 | 1.7K | |
| 3fcq_ligand_protonated.pdb | 2023-07-04 15:26 | 1.9K | |
| ligand_protonated.pdb | 2023-07-04 15:26 | 1.9K | |
| 3fcq_ligand_protonated.sdf | 2023-07-04 15:26 | 2.2K | |
| ligand_protonated.sdf | 2023-07-04 15:26 | 2.2K | |
| 3fcq_pocket.pdb | 2023-07-04 15:26 | 12K | |
| pocket.pdb | 2023-07-04 15:26 | 12K | |
| run000_ligand_system.xml | 2023-07-04 15:26 | 23K | |
| run001_ligand_system.xml | 2023-07-04 15:26 | 23K | |
| run000_ligand_ff.xml | 2023-07-04 15:26 | 70K | |
| run001_ligand_ff.xml | 2023-07-04 15:26 | 70K | |
| 3fcq_protein_cleaned.pdb | 2023-07-04 15:26 | 195K | |
| protein_cleaned.pdb | 2023-07-04 15:26 | 195K | |
| 3fcq_protein_protonated.pdb | 2023-07-04 15:26 | 373K | |
| protein_protonated.pdb | 2023-07-04 15:26 | 373K | |
| 3fcq_protein.pdb | 2023-07-04 15:26 | 384K | |
| protein.pdb | 2023-07-04 15:26 | 384K | |