Drug-like Density: A Method of Quantifying the "Bindability" of a Protein Target Based on a Very Large Set of Pockets and Drug-like Ligands from the Protein Data Bank.
Robert P. SheridanVladimir N. MaiorovM. Katharine HollowayWendy D. CornellYing-Duo GaoPublished in: J. Chem. Inf. Model. (2010)
Keyphrases
- initial set
- objective function
- high accuracy
- preprocessing
- input data
- cost function
- support vector machine
- significant improvement
- dynamic programming
- clustering method
- segmentation method
- density function
- knn
- pairwise
- detection method
- statistical methods
- image set
- protein structure
- feature space
- drug design
- method finds