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Improving the Scoring of Protein-Ligand Binding Affinity by Including the Effects of Structural Water and Electronic Polarization.
Jinfeng Liu
Xiao He
John Z. H. Zhang
Published in:
J. Chem. Inf. Model. (2013)
Keyphrases
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drug design
drug discovery
dna binding
virtual screening
protein structure
structural information
experimentally determined
binding sites
pairwise
protein protein
structural features
protein structural
protein sequences
high throughput
sequence similarity
protein protein interactions
amino acids