Gaussian Accelerated Molecular Dynamics: Unconstrained Enhanced Sampling and Free Energy Calculation-Reference-Cited by-同舟云学术

Gaussian Accelerated Molecular Dynamics: Unconstrained Enhanced Sampling and Free Energy Calculation

Published:2015-07-30 Issue:8 Volume:11 Page:3584-3595
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Miao Yinglong¹,Feher Victoria A.¹,McCammon J. Andrew¹

Affiliation:

1. Howard Hughes Medical Institute, ‡Department of Chemistry and Biochemistry, and §Department of Pharmacology, University of California at San Diego, La Jolla, California 92093, United States

Funder

Howard Hughes Medical Institute

Division of Molecular and Cellular Biosciences

NIH Office of the Director

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00436

Reference67 articles.

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3. Activation and allosteric modulation of a muscarinic acetylcholine receptor

4. Measurement of the millisecond activation switch of G protein–coupled receptors in living cells

5. Viral structural transitions: An all-atom multiscale theory

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