Fast drug-receptor mapping by site-directed distances: a novel method of predicting new pharmacological leads.
Andrew SmellieGordon M. CrippenW. Graham RichardsPublished in: J. Chem. Inf. Comput. Sci. (1991)
Keyphrases
- significant improvement
- website
- drug discovery
- synthetic data
- clustering method
- detection algorithm
- optimization algorithm
- probabilistic model
- decision trees
- fully automatic
- support vector machine
- dynamic programming
- cost function
- experimental evaluation
- support vector machine svm
- multiresolution
- pairwise
- preprocessing
- high precision
- objective function
- multiscale
- mapping function