Perspective:Ab initioforce field methods derived from quantum mechanics-Reference-Cited by-同舟云学术

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Perspective:Ab initioforce field methods derived from quantum mechanics

Published:2018-03-07 Issue:9 Volume:148 Page:090901
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Xu Peng¹,Guidez Emilie B.²^ORCID,Bertoni Colleen³,Gordon Mark S.¹

Affiliation:

1. Department of Chemistry and Ames Laboratory, Iowa State University, Ames, Iowa 50011, USA

2. Department of Chemistry, University of Colorado Denver, Denver, Colorado 80217, USA

3. Argonne Leadership Computing Facility, Argonne, Illinois 60439, USA

Funder

National Science Foundation

U.S. Department of Energy

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/am-pdf/10.1063/1.5009551

Reference159 articles.

1. CHARMM: A program for macromolecular energy, minimization, and dynamics calculations

2. Empirical energy functions for energy minimization and dynamics of nucleic acids

3. AMBER: Assisted model building with energy refinement. A general program for modeling molecules and their interactions

4. A new force field for molecular mechanical simulation of nucleic acids and proteins

5. An all atom force field for simulations of proteins and nucleic acids

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