A consistent description of HYdrogen bond and DEhydration energies in protein–ligand complexes: methods behind the HYDE scoring function
Published 2012 View Full Article
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Title
A consistent description of HYdrogen bond and DEhydration energies in protein–ligand complexes: methods behind the HYDE scoring function
Authors
Keywords
Protein–ligand interactions, Desolvation, Binding affinity, Virtual screening, Lead optimization, Docking
Journal
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
Volume 27, Issue 1, Pages 15-29
Publisher
Springer Nature
Online
2012-12-26
DOI
10.1007/s10822-012-9626-2
References
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