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Free energy simulations for protein ligand binding and stability

Published:2018-01-16 Issue:13-14 Volume:44 Page:1044-1061
ISSN:0892-7022
Container-title:Molecular Simulation
language:en
Short-container-title:Molecular Simulation

Author:

El Hage Krystel¹,Mondal Padmabati¹,Meuwly Markus¹

Affiliation:

1. Department of Chemistry, University of Basel , Basel, Switzerland.

Funder

Swiss National Science Foundation

University of Basel

Publisher

Informa UK Limited

Subject

Condensed Matter Physics,General Materials Science,General Chemical Engineering,Modeling and Simulation,Information Systems,General Chemistry

Link

https://www.tandfonline.com/doi/pdf/10.1080/08927022.2017.1416115

Reference194 articles.

1. Advances in Chemical Physics

2. Free Energy Via Molecular Simulation: Applications to Chemical and Biomolecular Systems

3. Computational Alchemy

4. Free energy calculations: Applications to chemical and biochemical phenomena

5. Free Energy Calculations

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