Drug-likeness analysis of traditional Chinese medicines: 1. property distributions of drug-like compounds, non-drug-like compounds and natural compounds from traditional Chinese medicines.
Mingyun ShenSheng TianYouyong LiQian LiXiaojie XuJunmei WangTingjun HouPublished in: J. Cheminformatics (2012)
Keyphrases
- drug discovery
- chemical compounds
- pharmaceutical industry
- virtual screening
- early stage
- drug design
- traditional chinese medicine
- data mining
- scientific data
- experimental data
- image analysis
- molecular structure
- systems biology
- discovery process
- chinese text
- natural language interface to databases
- cell lines
- clinical trials
- subgraph isomorphism
- word segmentation
- empirical analysis
- structural features
- knowledge discovery
- probability distribution
- case study