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Docking compared to 3D-pharmacophores: the scoring function challenge

โœ Scribed by Michael Hein; David Zilian; Christoph A. Sotriffer


Book ID
119226476
Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
253 KB
Volume
7
Category
Article
ISSN
1740-6749

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## Abstract Our laboratory has in the past developed a method for the prediction of ligand binding free energies to proteins, referred to as SAFE\_p (Solvent free energy predictor). Previously, we have applied this protocol for the prediction of the binding free energy of peptidic and cyclic urea H