TB-IECS: an accurate machine learning-based scoring function for virtual screening.
Xujun ZhangChao ShenDejun JiangJintu ZhangQing YeLei XuTingjun HouPeichen PanYu KangPublished in: J. Cheminformatics (2023)
Keyphrases
- scoring function
- virtual screening
- machine learning
- drug discovery
- similarity searching
- structure learning
- high throughput
- data analysis
- ranking functions
- feature selection
- machine learning algorithms
- statistical methods
- data mining
- information retrieval
- binding sites
- semi supervised learning
- text classification
- information extraction
- probability distribution
- search engine
- learning algorithm