From adaptive resolution to molecular dynamics of open systems

Robinson Cortes-Huerto, Matej Praprotnik, Kurt Kremer () and Luigi Delle Site ()
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Robinson Cortes-Huerto: Max Planck Institute for Polymer Research
Matej Praprotnik: University of Ljubljana
Kurt Kremer: Max Planck Institute for Polymer Research
Luigi Delle Site: Freie Universität Berlin

The European Physical Journal B: Condensed Matter and Complex Systems, 2021, vol. 94, issue 9, 1-22

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. Graphic abstract

Date: 2021
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DOI: 10.1140/epjb/s10051-021-00193-w

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