Files
DiffDock/data/protein_ligand_example.csv
Jacob Silterra e259429889 Add example CSV file
Meant to rename it earlier, accidentally just removed it.
2024-04-09 11:03:39 -04:00

3 lines
196 B
CSV

complex_name,protein_path,ligand_description,protein_sequence
1a0q,data/1a0q/1a0q_protein_processed.pdb,data/1a0q/1a0q_ligand.sdf,
1a0q_custom,data/1a0q/1a0q_protein_processed.pdb,COc(cc1)ccc1C#N,