Extracting Sets of Chemical Substructures and Protein Domains Governing Drug-Target Interactions.
Yoshihiro YamanishiEdouard PauwelsHiroto SaigoVéronique StovenPublished in: J. Chem. Inf. Model. (2011)
Keyphrases
- chemical compounds
- drug discovery
- protein interaction
- chemical reactions
- data structure
- cellular processes
- protein protein
- protein structure
- application domains
- subcellular localization
- virtual screening
- chemical reaction
- definite clause
- structural patterns
- dna binding
- real world
- information extraction
- graph databases
- interaction networks
- protein sequences
- amino acids
- graph data
- structural features
- protein protein interactions