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From adaptive resolution to molecular dynamics of open systems.
Cortes-Huerto, Robinson; Praprotnik, Matej; Kremer, Kurt; Delle Site, Luigi.
Afiliación
  • Cortes-Huerto R; Max Planck Institute for Polymer Research, Ackermannweg 10, 55128 Mainz, Germany.
  • Praprotnik M; Laboratory for Molecular Modeling, National Institute of Chemistry, Ljubljana, Slovenia and Department of Physics, Faculty of Mathematics and Physics, University of Ljubljana, Ljubljana, Slovenia.
  • Kremer K; Max Planck Institute for Polymer Research, Ackermannweg 10, 55128 Mainz, Germany.
  • Delle Site L; Department of Mathematics and Computer Science, Institute for Mathematics, Freie Universität Berlin, Berlin, Germany.
Eur Phys J B ; 94(9): 189, 2021.
Article en En | MEDLINE | ID: mdl-34720711
ABSTRACT
ABSTRACT We provide an overview of the Adaptive Resolution Simulation method (AdResS) based on discussing its basic principles and presenting its current numerical and theoretical developments. Examples of applications to systems of interest to soft matter, chemical physics, and condensed matter illustrate the method's advantages and limitations in its practical use and thus settle the challenge for further future numerical and theoretical developments.

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Eur Phys J B Año: 2021 Tipo del documento: Article País de afiliación: Alemania

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Eur Phys J B Año: 2021 Tipo del documento: Article País de afiliación: Alemania
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