Concepedia

Canonical Ensemble Sampling

Canonical Ensemble Sampling is a Monte Carlo simulation method that generates representative states of a physical system at thermal equilibrium by sampling configurations according to the Boltzmann distribution for a fixed number of particles, volume, and temperature, thereby enabling statistical mechanical analysis of systems in contact with a heat bath.

137

Publications

30.4K

Citations

330

Authors

197

Institutions

Publications per year

2017–2026

20

Parents

Publications

137

Canonical sampling through velocity rescaling

Giovanni Bussi, Davide Donadio, Michele Parrinello · The Journal of Chemical Physics · 2007 · 18.4K citations · Full text

, , +17

Well-Tempered Metadynamics: A Smoothly Converging and Tunable Free-Energy Method

Alessandro Barducci, Giovanni Bussi, Michele Parrinello · Physical Review Letters · 2008 · 3.3K citations · Full text

, , +15

Grand canonical ensemble Monte Carlo for a Lennard-Jones fluid

David J. Adams · Molecular Physics · 1975 · 516 citations

, , +15

Monte Carlo methods in Materials Studio

Reinier Akkermans, Neil A. Spenley, Struan H. Robertson · Molecular Simulation · 2013 · 434 citations

, , +17

Multicanonical Ensemble Generated by Molecular Dynamics Simulation for Enhanced Conformational Sampling of Peptides

Nobuyuki Nakajima, Haruki Nakamura, Akinori Kidera · The Journal of Physical Chemistry B · 1997 · 405 citations

, , +17

1–5 of 137

Authors

330

  1. BL
    Benedict Leimkuhler

    University of Edinburgh, United Kingdom

    6 publications · 182 citations

    6

    h-index

  2. HN
    Haruki Nakamura

    The University of Osaka, Japan

    4 publications · 476 citations

    4

    h-index

  3. JH
    Junichi Higo

    The University of Osaka, Japan

    4 publications · 81 citations

    4

    h-index

  4. MP
    Michele Parrinello

    ETH Zurich, Switzerland

    4 publications · 22.3K citations

    4

    h-index

  5. ZZ
    Zhijun Zhang

    Chinese Academy of Sciences, China

    3 publications · 283 citations

    3

    h-index

1–5 of 330

Institutions

197

  1. ETH Zurich

    Zurich, Switzerland

    6 h-index

    13 publications

    65.7K citations

  2. University of Edinburgh

    Edinburgh, United Kingdom

    4 h-index

    7 publications

    241 citations

  3. University of Monastir

    Monastir, Tunisia

    4 h-index

    13 publications

    248 citations

  4. Maxwell Institute for Mathematical Sciences

    Edinburgh, United Kingdom

    4 h-index

    6 publications

    158 citations

  5. The University of Osaka

    Osaka, Japan

    4 h-index

    8 publications

    180 citations

  6. National Institute of Advanced Industrial Science and Technology

    Tsukuba, Japan

    3 h-index

    4 publications

    60 citations

  7. National Institutes of Health

    Bethesda, United States

    3 h-index

    6 publications

    172 citations

  8. Technische Universität Berlin

    Berlin, Germany

    3 h-index

    6 publications

    80 citations

1–8 of 197

Venues

  1. The Journal of Chemical Physics

    41 publications · 20.7K citations

    25

    h-index

  2. Molecular Physics

    9 publications · 1.7K citations

    9

    h-index

  3. The Journal of Physical Chemistry B

    7 publications · 1K citations

    7

    h-index

  4. Physical Review Letters

    PRL · 5 publications · 3.8K citations

    5

    h-index

  5. Physical review. B, Condensed matter

    PRB · 5 publications · 312 citations

    5

    h-index

1–5