https://doi.org/10.1140/epjb/s10051-021-00193-w
Topical Review - Computational Methods
From adaptive resolution to molecular dynamics of open systems
1
Max Planck Institute for Polymer Research, Ackermannweg 10, 55128, Mainz, Germany
2
Laboratory for Molecular Modeling, National Institute of Chemistry, Ljubljana, Slovenia and Department of Physics, Faculty of Mathematics and Physics, University of Ljubljana, Ljubljana, Slovenia
3
Department of Mathematics and Computer Science, Institute for Mathematics, Freie Universität Berlin, Berlin, Germany
c
kremer@mpip-mainz.mpg.de
d
luigi.dellesite@fu-berlin.de
Received:
21
May
2021
Accepted:
31
August
2021
Published online:
23
September
2021
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.
© The Author(s) 2021
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