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Polarization effects in molecular mechanical force fields

Author
CIEPLAK, Piotr1 ; DUPRADEAU, François-Yves2 ; YONG DUAN3 ; JUNMEI WANG4
[1] Burnham Institute for Medical Research, 10901 North Torrey Pines Road, La Jolla, CA 92120, United States
[2] UMR CNRS 6219―Faculte de Pharmacie, Université de Picardie Jules Verne, 1 rue des Louvels, 80037 Amiens, France
[3] Genome Center and Department of Applied Science, University of California, Davis, One Shields Avenue, Davis, CA 95616, United States
[4] Department of Pharmacology, University of Texas Southwestern Medical Center, 6001 Forest Park Boulevard, ND9.136, Dallas, TX 75390-9050, United States
Source

Journal of physics. Condensed matter (Print). 2009, Vol 21, Num 33 ; 333102.1-333102.21 ; ref : 4 p

CODEN
JCOMEL
ISSN
0953-8984
Scientific domain
Crystallography; Metallurgy, welding; Condensed state physics
Publisher
Institute of Physics, Bristol
Publication country
United Kingdom
Document type
Article
Language
English
Keyword (fr)
Continuum Fluctuation charge Force intermoléculaire Interaction intermoléculaire Modèle Drude Modélisation Méthode champ force Paramétrisation Polarisabilité Polarisation Théorie quantique 3420G
Keyword (en)
Continuum Charge fluctuation Intermolecular forces Intermolecular interaction Drude model Modelling Force field method Parameterization Polarizability Polarization Quantum theory
Keyword (es)
Continuo Interacción intermolecular Método campo fuerza Parametrización
Classification
Pascal
001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30D Atomic and molecular collision processes and interactions / 001B30D20 Interatomic and intermolecular potentials and forces, potential energy surfaces for collisions / 001B30D20G Intermolecular and atom-molecule potentials and forces

Discipline
Atomic and molecular physics
Origin
Inist-CNRS
Database
PASCAL
INIST identifier
21820508

Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS

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