Novel 2D Fingerprints for Ligand-Based Virtual Screening.

Todd Ewing J. Christian Baber Miklos Feher

Published in: J. Chem. Inf. Model. (2006)

Keyphrases

virtual screening
drug discovery
chemical structures
similarity searching
high throughput
binding sites
scoring function
similarity search
optimal assignment
data analysis
gene expression
metric space
access methods