Conformational Enantiomerization and Estrogen Receptor α Binding of Anti-Cancer Drug Tamoxifen and Its Derivatives.
Li GaoYaoquan TuPia WegmanSten WingrenLeif A. ErikssonPublished in: J. Chem. Inf. Model. (2011)
Keyphrases
- drug discovery
- breast cancer
- hiv protease
- drug resistance
- coarse grained
- higher order
- pharmaceutical industry
- drug design
- early detection
- protein protein interactions
- scientific data
- chemical compounds
- security protection
- logistic regression
- early stage
- biological systems
- fine grained
- finite difference
- low energy
- quasi invariant
- data sets
- encoding schemes
- linear support vector machines
- sequence analysis
- data mining