An efficient in silico screening method based on the protein-compound affinity matrix and its application to the design of a focused library for cytochrome P450 (CYP) ligands. [electronic resource]
Producer: 20070215Description: 2610-22 p. digitalISSN:- 1549-9596
- Artificial Intelligence
- Binding Sites
- Chemistry, Pharmaceutical -- methods
- Combinatorial Chemistry Techniques
- Cytochrome P-450 Enzyme System -- chemistry
- Drug Evaluation, Preclinical -- methods
- Drug Industry
- Humans
- Ligands
- Models, Chemical
- Models, Statistical
- Polymorphism, Genetic
- Principal Component Analysis
- Proteins -- chemistry
- Quantitative Structure-Activity Relationship
- Technology, Pharmaceutical -- methods
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Publication Type: Journal Article; Research Support, Non-U.S. Gov't
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