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WIREs Comput Mol Sci
Impact Factor: 14.016

Free Energy Methods

Molecular ‘time‐machines’ to unravel key biological events for drug design

Overview
Aravindhan Ganesan, Michelle L. Coote, Khaled Barakat
Published Online: May 02 2017
DOI:10.1002/wcms.1306

Abstract Full article on Wiley Online Library:   HTML | PDF
Coarse‐grained models of water

Overview
Leonardo Darré, Matías R. Machado, Sergio Pantano
Published Online: Jun 06 2012
DOI:10.1002/wcms.1097

Abstract Full article on Wiley Online Library:   HTML | PDF
The COSMO and COSMO‐RS solvation models

Advanced Review
Andreas Klamt
Published Online: Apr 28 2011
DOI:10.1002/wcms.56

Abstract Full article on Wiley Online Library:   HTML | PDF
Metadynamics

Advanced Review
Alessandro Barducci, Massimiliano Bonomi, Michele Parrinello
Published Online: Feb 18 2011
DOI:10.1002/wcms.31

Abstract Full article on Wiley Online Library:   HTML | PDF

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