Maximum-Score Diversity Selection for Early Drug Discovery.

Thorsten Meinl Claude Ostermann Michael R. Berthold

Published in: J. Chem. Inf. Model. (2011)

Keyphrases

drug discovery
chemical compounds
pharmaceutical industry
early stage
virtual screening
scientific data
knowledge discovery
data mining tools
discovery process
preprocessing
data mining
high throughput
databases
biological systems
systems biology
association rules
similarity measure