Concepedia

Monte Carlo Sampling

Monte Carlo Sampling is a stochastic conformational sampling method that generates molecular configurations through random perturbations accepted or rejected based on an energy-biased criterion to approximate the thermodynamic ensemble of states.

3.4K

Publications

267.1K

Citations

7.7K

Authors

2K

Institutions

Publications per year

2017–2026

567

Parents

Publications

3.4K

<tt>emcee</tt>: The MCMC Hammer

Publications of the Astronomical Society of the Pacific · 2013 · 11.9K citations · Full text

, , +14

Glide:  A New Approach for Rapid, Accurate Docking and Scoring. 1. Method and Assessment of Docking Accuracy

Richard A. Friesner, Jay L. Banks, Robert B. Murphy et al. · Journal of Medicinal Chemistry · 2004 · 9.9K citations

, , +17

PANEL COINTEGRATION: ASYMPTOTIC AND FINITE SAMPLE PROPERTIES OF POOLED TIME SERIES TESTS WITH AN APPLICATION TO THE PPP HYPOTHESIS

Peter Pedroni · Econometric Theory · 2004 · 6.5K citations

, , +16

Nonphysical sampling distributions in Monte Carlo free-energy estimation: Umbrella sampling

G. M. Torrie, J. P. Valleau · Journal of Computational Physics · 1977 · 6.2K citations

, , +12

Ensemble samplers with affine invariance

Jonathan Goodman, Jonathan Weare · Communications in Applied Mathematics and Computational Science · 2010 · 3.1K citations · Full text

, , +15

1–5 of 3.4K

Authors

7.7K

  1. DF
    Daan Frenkel

    Institute for Atomic and Molecular Physics, Netherlands

    16 publications · 2.6K citations

    16

    h-index

  2. JS
    Jeffrey Skolnick

    Georgia Institute of Technology, United States

    16 publications · 874 citations

    15

    h-index

  3. KB
    Kurt Binder

    Johannes Gutenberg University Mainz, Germany

    19 publications · 764 citations

    15

    h-index

  4. AK
    Andrzej Koliński

    University of Warsaw, Poland

    14 publications · 608 citations

    14

    h-index

  5. DA
    David A. Kofke

    University at Buffalo, State University of New York, United States

    15 publications · 849 citations

    14

    h-index

1–5 of 7.7K

Institutions

2K

  1. Centre National de la Recherche Scientifique

    Paris, France

    37 h-index

    353 publications

    17.7K citations

  2. University of Cambridge

    Cambridge, United Kingdom

    34 h-index

    117 publications

    8.8K citations

  3. University of California, Berkeley

    Berkeley, United States

    32 h-index

    134 publications

    9.3K citations

  4. Cornell University

    Ithaca, United States

    32 h-index

    101 publications

    14.1K citations

  5. Los Alamos National Laboratory

    Los Alamos, United States

    31 h-index

    87 publications

    7.7K citations

  6. University of Chicago

    Chicago, United States

    29 h-index

    65 publications

    7.4K citations

  7. Stanford University

    Stanford, United States

    29 h-index

    74 publications

    6.2K citations

  8. Carnegie Mellon University

    Pittsburgh, United States

    28 h-index

    77 publications

    10.2K citations

1–8 of 2K

Venues

  1. The Journal of Chemical Physics

    386 publications · 26.3K citations

    81

    h-index

  2. Physical Review Letters

    PRL · 104 publications · 19.5K citations

    58

    h-index

  3. Physical review. B, Condensed matter

    PRB · 69 publications · 4.5K citations

    34

    h-index

  4. Molecular Physics

    58 publications · 6.5K citations

    33

    h-index

  5. Journal of Chemical Theory and Computation

    JCTC · 51 publications · 2.2K citations

    30

    h-index

1–5