Predicting drug polypharmacology using a novel surface property similarity-based approach.
Violeta I. Pérez-NuenoVishwesh VenkatramanLazaros MavridisDavid W. RitchiePublished in: J. Cheminformatics (2011)
Keyphrases
- similarity measure
- surface reconstruction
- similarity measurement
- euclidean distance
- d objects
- three dimensional
- distance measure
- free form
- distance function
- semantic similarity
- shape index
- similarity metric
- object surface
- normal vectors
- surface registration
- triangular inequality
- surface features
- drug discovery
- clinical trials
- reconstruction method
- dissimilarity measure
- user defined