Concepedia

Force Field Models

Force Field Models is a computational framework in particle-based simulation that specifies the mathematical form and parameters of interatomic or intermolecular interactions, distinguishing itself by defining the potential energy functions and associated forces that govern the dynamical behavior of particles within a simulated system.

3.3K

Publications

396K

Citations

8K

Authors

1.9K

Institutions

Publications per year

2017–2026

713

Parents

Publications

3.3K

Development and testing of a general amber force field

Junmei Wang, Romain M. Wolf, James W. Caldwell et al. · Journal of Computational Chemistry · 2004 · 19.6K citations

, , +17

GROMACS: Fast, flexible, and free

David van der Spoel, Erik Lindahl, Berk Hess et al. · Journal of Computational Chemistry · 2005 · 19.1K citations

, , +17

Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids

William L. Jorgensen, David S. Maxwell, Julian Tirado‐Rives · Journal of the American Chemical Society · 1996 · 15.3K citations

, , +17

CHARMM36m: an improved force field for folded and intrinsically disordered proteins

Jing Huang, Sarah Rauscher, Grzegorz Nawrocki et al. · Nature Methods · 2016 · 7.6K citations · Full text

, , +12

CHARMM general force field: A force field for drug‐like molecules compatible with the CHARMM all‐atom additive biological force fields

Kenno Vanommeslaeghe, Elizabeth Hatcher, Chitrangada Acharya et al. · Journal of Computational Chemistry · 2009 · 7.5K citations · Full text

, , +17

1–5 of 3.3K

Authors

8K

  1. AD
    Alexander D. MacKerell

    University of Maryland, Baltimore, United States

    43 publications · 33.2K citations

    35

    h-index

  2. WF
    Wilfred F. van Gunsteren

    ETH Zurich, Switzerland

    38 publications · 11K citations

    29

    h-index

  3. WA
    William A. Goddard

    California Institute of Technology, United States

    33 publications · 8.7K citations

    26

    h-index

  4. AC
    Adri C. T. van Duin

    Pennsylvania State University, United States

    39 publications · 9.3K citations

    26

    h-index

  5. NL
    Norman L. Allinger

    University of Georgia, United States

    37 publications · 6.4K citations

    25

    h-index

1–5 of 8K

Institutions

1.9K

  1. Centre National de la Recherche Scientifique

    Paris, France

    50 h-index

    430 publications

    32.5K citations

  2. University of Maryland, Baltimore

    Baltimore, United States

    37 h-index

    127 publications

    161.6K citations

  3. University of Minnesota

    Minneapolis, United States

    30 h-index

    119 publications

    13.8K citations

  4. Pennsylvania State University

    State College, United States

    29 h-index

    116 publications

    9.7K citations

  5. ETH Zurich

    Zurich, Switzerland

    29 h-index

    119 publications

    15K citations

  6. California Institute of Technology

    Pasadena, United States

    28 h-index

    117 publications

    33.7K citations

  7. Cornell University

    Ithaca, United States

    28 h-index

    161 publications

    12K citations

  8. University of Michigan

    Ann Arbor, United States

    26 h-index

    100 publications

    23.4K citations

1–8 of 1.9K

Venues

  1. The Journal of Physical Chemistry B

    309 publications · 39.3K citations

    84

    h-index

  2. Journal of Chemical Theory and Computation

    JCTC · 244 publications · 35.1K citations

    76

    h-index

  3. Journal of Computational Chemistry

    229 publications · 94.9K citations

    75

    h-index

  4. The Journal of Chemical Physics

    282 publications · 22.9K citations

    70

    h-index

  5. Journal of the American Chemical Society

    JACS · 79 publications · 33.8K citations

    54

    h-index

1–5