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Characterization of Small Molecule Binding. I. Accurate Identification of Strong Inhibitors in Virtual Screening.
Bo Ding
Jian Wang
Nan Li
Wei Wang
Published in:
J. Chem. Inf. Model. (2013)
Keyphrases
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drug discovery
virtual screening
chemical structures
database
data analysis
data points
nearest neighbor
data management
high precision
high throughput
scientific data
systems biology
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