Calculation of Configurational Entropy Differences from Conformational Ensembles Using Gaussian Mixtures
Author:
Affiliation:
1. Institute of Enzymology, Research Centre for Natural Sciences, Hungarian Academy of Sciences, Magyar tudósok krt. 2, H-1117 Budapest, Hungary
Funder
Országos Tudományos Kutatási Alapprogramok
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.6b00837
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1. Temperature dependence of the hydrophobic interaction in protein folding.
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4. Method for estimating the configurational entropy of macromolecules
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