Drug-likeness analysis of traditional Chinese medicines: 2. Characterization of scaffold architectures for drug-like compounds, non-drug-like compounds, and natural compounds from traditional Chinese medicines.
Sheng TianYouyong LiJunmei WangXiaojie XuLei XuXiaohong WangLei ChenTingjun HouPublished in: J. Cheminformatics (2013)
Keyphrases
- drug discovery
- chemical compounds
- pharmaceutical industry
- drug design
- virtual screening
- molecular structure
- experimental data
- early stage
- real time
- structural features
- discovery process
- systems biology
- data analysis
- genetic algorithm
- character recognition
- traditional chinese medicine
- information systems
- machine learning
- data sets