Cavka - a new automatic pharmacophore elucidation method in progress.
Florian KoellingKnut BaumannPublished in: J. Cheminformatics (2011)
Keyphrases
- detection method
- high accuracy
- experimental evaluation
- evaluation method
- fully automatic
- high precision
- clustering method
- main contribution
- computationally efficient
- computational cost
- dynamic programming
- cost function
- significant improvement
- pairwise
- classification accuracy
- detection algorithm
- evolutionary algorithm
- synthetic data
- similarity measure
- feature selection