Parametrizing a polarizable force field from ab initio data. I. The fluctuating point charge model-Reference-Cited by-同舟云学术

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Parametrizing a polarizable force field from ab initio data. I. The fluctuating point charge model

Published:1999-01-08 Issue:2 Volume:110 Page:741-754
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Banks Jay L.,Kaminski George A.,Zhou Ruhong,Mainz Daniel T.,Berne B. J.,Friesner Richard A.

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.478043

Reference31 articles.

1. Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids

2. A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules

3. Derivation of class II force fields. I. Methodology and quantum force field for the alkyl functional group and alkane molecules

4. Derivation of Class II Force Fields. 2. Derivation and Characterization of a Class II Force Field, CFF93, for the Alkyl Functional Group and Alkane Molecules

5. An all-atom empirical energy function for the simulation of nucleic acids

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