A Probabilistic Framework for Constructing Temporal Relations in Replica Exchange Molecular Trajectories-Reference-Cited by-同舟云学术

A Probabilistic Framework for Constructing Temporal Relations in Replica Exchange Molecular Trajectories

Published:2018-05-23 Issue:7 Volume:14 Page:3365-3380
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Chattopadhyay Aditya¹,Zheng Min²,Waller Mark P.³^ORCID,Priyakumar U. Deva¹^ORCID

Affiliation:

1. Centre for Computational Natural Sciences and Bioinformatics, International Institute of Information Technology, Hyderabad 500032, India

2. Centre for Multiscale Theory and Computation, Westfälische Wilhelms-Universität Münster, Münster, Germany

3. Department of Physics and International Centre for Quantum and Molecular Structures, Shanghai University, Shanghai, 200444, People’s Republic of China

Funder

Science and Engineering Research Board

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.7b01245

Reference104 articles.

1. All-Atom Structure Prediction and Folding Simulations of a Stable Protein

2. Molecular Dynamics Simulations of the Protein Unfolding/Folding Reaction

3. Pathways to a Protein Folding Intermediate Observed in a 1-Microsecond Simulation in Aqueous Solution

4. Protein and Peptide Folding Explored with Molecular Simulations

5. Protein-Folding Dynamics: Overview of Molecular Simulation Techniques

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