The Virtual Screening of the Drug Protein with a Few Crystal Structures Based on the Adaboost-SVM.
Meng-yu WangLi PengPeili QiaoPublished in: Comput. Math. Methods Medicine (2016)
Keyphrases
- virtual screening
- drug discovery
- support vector
- chemical structures
- similarity searching
- chemical compounds
- multi class
- feature selection
- scoring function
- binding sites
- training data
- support vector machine
- high throughput
- learning algorithm
- feature vectors
- machine learning
- structural features
- knn
- training set
- feature space
- decision trees
- gene expression
- similarity search
- early stage
- biological systems
- kernel function