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Generalized Verlet algorithm for efficient molecular dynamics simulations with long-range interactions

Author
GRUBMÜLLER, H; HELLER, H; WINDEMUTH, A; SCHULTEN, K
Univ. Illinois, Beckman inst., Urbana IL 61801, United States
Source

Molecular simulation. 1991, Vol 6, Num 1-3, pp 121-142 ; ref : 15 ref

ISSN
0892-7022
Scientific domain
Physics
Publisher
Gordon and Breach, London / Gordon and Breach, New York, NY / Gordon and Breach, Paris
Publication country
United States
Document type
Article
Language
English
Keyword (fr)
Algorithme Dynamique moléculaire Etude théorique Interaction longue distance Molécule Polymère Simulation ordinateur Classe dis
Keyword (en)
Algorithm Molecular dynamics Theoretical study Long range interaction Molecules Polymer Computer simulation
Keyword (es)
Algoritmo Dinámica molecular Estudio teórico Interacción larga distancia Molécula Polímero Simulación computadora
Classification
Pascal
001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30A Electronic structure of atoms, molecules and their ions: theory / 001B30A15 Calculations and mathematical techniques in atomic and molecular physics (excluding electron correlation calculations)

Discipline
Atomic and molecular physics
Origin
Inist-CNRS
Database
PASCAL
INIST identifier
5364277

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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