Protonation States of Remote Residues Affect Binding–Release Dynamics of the Ligand but Not the Conformation of Apo Ferric Binding Protein
Author:
Affiliation:
1. Sabanci University, Faculty of Engineering and Natural Sciences, Tuzla 34956 Istanbul, Turkey
Funder
Türkiye Bilimsel ve Teknolojik Arastirma Kurumu
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp5079218
Reference59 articles.
1. Accounting for Receptor Flexibility and Enhanced Sampling Methods in Computer-Aided Drug Design
2. Entropy-enthalpy transduction caused by conformational shifts can obscure the forces driving protein-ligand binding
3. The fundamental role of flexibility on the strength of molecular binding
4. Glide: A New Approach for Rapid, Accurate Docking and Scoring. 1. Method and Assessment of Docking Accuracy
5. Funnel metadynamics as accurate binding free-energy method
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