Ligand-Protein Docking with Water Molecules.
Benjamin C. RobertsRicardo L. ManceraPublished in: J. Chem. Inf. Model. (2008)
Keyphrases
- virtual screening
- drug discovery
- similarity searching
- chemical compounds
- drug design
- molecular structures
- binding sites
- high throughput
- water quality
- scoring function
- similarity search
- protein protein
- water resources
- chemical reactions
- sequence alignment
- protein structure prediction
- protein protein interactions
- scientific data
- water supply
- protein sequences