Canonical ensemble simulation of biopolymers using a coarse-grained articulated generalized divide-and-conquer scheme

DOI10.1016/j.cpc.2012.10.029zbMath1302.82137OpenAlexW1978798085MaRDI QIDQ483854

Kurt S. Anderson, Mohammad Poursina

Publication date: 17 December 2014

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

Full work available at URL: https://doi.org/10.1016/j.cpc.2012.10.029

zbMATH Keywords

canonical ensemblemultibody dynamicsNosé-Hoover thermostatcoarse-grained modelinggeneralized divide-and-conquer-algorithmthermostat generalized feedback force

Mathematics Subject Classification ID

Related Items (3)

Long-term dynamic simulation of adipogenic differentiation of a human mesenchymal stem cell ⋮ Extension of the divide-and-conquer algorithm for the efficient inverse dynamics analysis of multibody systems ⋮ Geometrically exact beam equations in the adaptive DCA framework. I: Static example

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