Download Database
Format | Description | MD5 checksum | |
---|---|---|---|
SANCDB smiles | Single SMILES file. Format: SMILES Name ID | 39cd1bd78b472254ad1c2143250f98f0 | Download |
SANCDB SDF | Single SDF file | 97c9bb6b5765169d9f406d4868602bda | Download |
Mol2 | Zip file containing one file per compound | 7531fe34ce309db9f49f92de37920f72 | Download |
PDB | Zip file containing one file per compound | 0a88105ca647725b6961b6b58d15a4ba | Download |
PDBQT | Zip file containing one file per compound | 0f19b9214b53e015a047a170a82ea9b8 | Download |
SDF | Zip file containing one file per compound | 8b7f0f0d81aaaacc406c72b267a6d28c | Download |
SMILES | Zip file containing one file per compound | 8f0e44d53775dd2ded9fa27bf2459953 | Download |
Maestro | Zip file containing one file per compound | 44a7ce42822970dc1cc39bb754ae40fa | Download |