Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs.
Christel A. S. BergströmUlf NorinderKristina LuthmanPer ArturssonPublished in: J. Chem. Inf. Comput. Sci. (2003)
Keyphrases
- three dimensional
- feature vectors
- classification accuracy
- pattern recognition
- image classification
- machine learning
- decision trees
- drug design
- feature space
- automatic classification
- feature extraction
- classification systems
- classification scheme
- shape descriptors
- support vector machine
- image retrieval
- training set
- feature set
- data mining
- text classification
- svm classifier
- classification method
- feature selection
- multiscale