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mRAISE: an alternative algorithmic approach to ligand-based virtual screening.
Mathias M. von Behren
Stefan Bietz
Eva Nittinger
Matthias Rarey
Published in:
J. Comput. Aided Mol. Des. (2016)
Keyphrases
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virtual screening
drug discovery
chemical structures
similarity searching
high throughput
binding sites
scoring function
similarity search
metric space
knowledge discovery
multi dimensional
gene expression
data sets
r tree
web search
pairwise
databases