Combination of the Replica-Exchange Monte Carlo Method and the Reference Interaction Site Model Theory for Simulating a Peptide Molecule in Aqueous Solution-Reference-Cited by-同舟云学术

Combination of the Replica-Exchange Monte Carlo Method and the Reference Interaction Site Model Theory for Simulating a Peptide Molecule in Aqueous Solution

Published:2004-11-12 Issue:49 Volume:108 Page:19002-19012
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Mitsutake Ayori¹,Kinoshita Masahiro¹,Okamoto Yuko¹,Hirata Fumio¹

Affiliation:

1. Department of Physics, Faculty of Science and Technology, Keio University, Yokohama, Kanagawa 223-8522, Japan, Advanced Energy Utilization Division, Institute of Advanced Energy, Kyoto University, Uji-shi, Kyoto 611-0011, Japan, Department of Theoretical Studies, Institute for Molecular Science, Okazaki, Aichi 444-8585, Japan, and Department of Functional Molecular Science, The Graduate University for Advanced Studies, Okazaki, Aichi 444-8585, Japan

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/jp047824d

Reference45 articles.

1. Cold denaturation of myoglobin

2. Optimized Cluster Expansions for Classical Fluids. II. Theory of Molecular Liquids

3. An extended rism equation for molecular polar fluids

4. A dielectrically consistent interaction site theory for solvent—electrolyte mixtures

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