A reference implementation of the adaptive resolution scheme in \texttt{ESPResSo}

DOI10.1016/j.cpc.2010.04.013zbMath1219.81284OpenAlexW2091653428WikidataQ59223097 ScholiaQ59223097MaRDI QIDQ547051

Simón Poblete, Christoph Junghans

Publication date: 30 June 2011

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/j.cpc.2010.04.013

zbMATH Keywords

molecular dynamicsmultiscalescale bridging

Mathematics Subject Classification ID

Quantum optics (81V80) Computational methods for problems pertaining to quantum theory (81-08)

Related Items

AdResS, ESPResSo 3.1: Molecular Dynamics Software for Coarse-Grained Models

Uses Software

• Gromacs
• ESPResSo

Cites Work

• Fractional dimensions of phase space variables: a tool for varying the degrees of freedom of a system in a multiscale treatment
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