Thermodynamic Characterization of New Positive Allosteric Modulators Binding to the Glutamate Receptor A2 Ligand-Binding Domain: Combining Experimental and Computational Methods Unravels Differences in Driving Forces-Reference-Cited by-同舟云学术

Thermodynamic Characterization of New Positive Allosteric Modulators Binding to the Glutamate Receptor A2 Ligand-Binding Domain: Combining Experimental and Computational Methods Unravels Differences in Driving Forces

Published:2014-12-09 Issue:12 Volume:54 Page:3404-3416
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Nørholm Ann-Beth¹²,Francotte Pierre³,Goffin Eric³,Botez Iuliana⁴,Danober Laurence⁵,Lestage Pierre⁵,Pirotte Bernard³,Kastrup Jette S.¹,Olsen Lars¹,Oostenbrink Chris²

Affiliation:

1. Department of Drug Design and Pharmacology, Faculty of Health and Medical Sciences, University of Copenhagen, Universitetsparken 2, DK-2100 Copenhagen, Denmark

2. Institute of Molecular Modeling and Simulation, University of Natural Resources and Life Sciences, Muthgasse 18, A-1190 Vienna, Austria

3. Department of Medicinal Chemistry, Center for Interdisciplinary Research on Medicines (CIRM), University of Liege, Avenue de l’Hôpital, 1, B36, B-4000 Liège, Belgium

4. Pôle d’Expertise Chimie-Chimie Médicinale, Institut de Recherches Servier, 129 Chemin de Ronde, F-78290 Croissy-sur-Seine, France

5. Pôle d’Innovation Thérapeutique en Neuropsychiatrie, Institut de Recherches Servier, 129 Chemin de Ronde, F-78290 Croissy-sur-Seine, France

Funder

European Research Council

University of Copenhagen

Vienna Science and Technology Fund

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci500559b