Discovery of α7-Nicotinic Receptor Ligands by Virtual Screening of the Chemical Universe Database GDB-13.
Lorenz C. BlumRuud van DeursenSonia BertrandMilena MayerJustus J. BürgiDaniel BertrandJean-Louis ReymondPublished in: J. Chem. Inf. Model. (2011)
Keyphrases
- virtual screening
- chemical structures
- drug discovery
- similarity searching
- database
- discovery process
- chemical compounds
- early stage
- data mining
- knowledge discovery
- binding sites
- scientific data
- systems biology
- high throughput
- scoring function
- databases
- data sets
- database systems
- similarity search
- data model
- biological systems
- query processing
- relational databases