An iterative knowledge-based scoring function to predict protein-ligand interactions: I. Derivation of interaction potentials.
Sheng-You HuangXiaoqin ZouPublished in: J. Comput. Chem. (2006)
Keyphrases
- scoring function
- virtual screening
- protein interaction
- predicting protein
- protein protein
- protein protein interactions
- binding sites
- drug discovery
- drug design
- structure learning
- protein function
- scoring functions
- similarity searching
- high throughput
- computational methods
- protein complexes
- secondary structure
- gene expression
- protein interaction networks
- biological data
- protein structure
- interaction networks
- dna sequences
- bayesian networks
- maximum likelihood
- feature extraction