Literature DB >> 19810318

Parallel tempering: theory, applications, and new perspectives.

David J Earl1, Michael W Deem.   

Abstract

We review the history of the parallel tempering simulation method. From its origins in data analysis, the parallel tempering method has become a standard workhorse of physicochemical simulations. We discuss the theory behind the method and its various generalizations. We mention a selected set of the many applications that have become possible with the introduction of parallel tempering, and we suggest several promising avenues for future research.

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Year:  2005        PMID: 19810318     DOI: 10.1039/b509983h

Source DB:  PubMed          Journal:  Phys Chem Chem Phys        ISSN: 1463-9076            Impact factor:   3.676


  132 in total

1.  Langevin dynamics simulation of polymer-assisted virus-like assembly.

Authors:  J P Mahalik; M Muthukumar
Journal:  J Chem Phys       Date:  2012-04-07       Impact factor: 3.488

2.  Accurate de novo structure prediction of large transmembrane protein domains using fragment-assembly and correlated mutation analysis.

Authors:  Timothy Nugent; David T Jones
Journal:  Proc Natl Acad Sci U S A       Date:  2012-05-29       Impact factor: 11.205

3.  Monte Carlo phase diagram for diblock copolymer melts.

Authors:  T M Beardsley; M W Matsen
Journal:  Eur Phys J E Soft Matter       Date:  2010-07-28       Impact factor: 1.890

4.  Generalized replica exchange method.

Authors:  Jaegil Kim; Thomas Keyes; John E Straub
Journal:  J Chem Phys       Date:  2010-06-14       Impact factor: 3.488

5.  Simulations of thermodynamics and kinetics on rough energy landscapes with milestoning.

Authors:  Juan M Bello-Rivas; Ron Elber
Journal:  J Comput Chem       Date:  2015-08-12       Impact factor: 3.376

6.  Turning statistical physics models into materials design engines.

Authors:  Marc Z Miskin; Gurdaman Khaira; Juan J de Pablo; Heinrich M Jaeger
Journal:  Proc Natl Acad Sci U S A       Date:  2015-12-18       Impact factor: 11.205

7.  Oxidation-induced destabilization of the fibrinogen αC-domain dimer investigated by molecular dynamics simulations.

Authors:  Eric N Pederson; Gianluca Interlandi
Journal:  Proteins       Date:  2019-06-14

8.  Efficient Algorithms for Searching the Minimum Information Partition in Integrated Information Theory.

Authors:  Jun Kitazono; Ryota Kanai; Masafumi Oizumi
Journal:  Entropy (Basel)       Date:  2018-03-06       Impact factor: 2.524

9.  Parameter Estimation and Uncertainty Quantification for Systems Biology Models.

Authors:  Eshan D Mitra; William S Hlavacek
Journal:  Curr Opin Syst Biol       Date:  2019-11-06

10.  In silico protein fragmentation reveals the importance of critical nuclei on domain reassembly.

Authors:  Lydia M Contreras Martínez; Ernesto E Borrero Quintana; Fernando A Escobedo; Matthew P DeLisa
Journal:  Biophys J       Date:  2007-11-09       Impact factor: 4.033

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