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The Effect of Ligand-Based Tautomer and Protomer Prediction on Structure-Based Virtual Screening.
Tuomo Kalliokoski
Heikki S. Salo
Maija Lahtela-Kakkonen
Antti Poso
Published in:
J. Chem. Inf. Model. (2009)
Keyphrases
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virtual screening
drug discovery
similarity searching
binding sites
chemical structures
data mining
multimedia
knowledge discovery
multi dimensional
high throughput