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Improving Virtual Screening Performance against Conformational Variations of Receptors by Shape Matching with Ligand Binding Pocket.
Hui Sun Lee
Cheol Soon Lee
Jeong Sook Kim
Dong Hou Kim
Han Choe
Published in:
J. Chem. Inf. Model. (2009)
Keyphrases
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shape matching
virtual screening
drug discovery
similarity searching
object recognition
shape descriptors
shape representation
binding sites
image matching
high throughput
similarity search
computer vision
matching algorithm
hiv protease
scoring function
shape prior
early stage
metric space
image registration