General purpose molecular dynamics simulations fully implemented on graphics processing units
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Publication:924525
DOI10.1016/j.jcp.2008.01.047zbMath1148.81301OpenAlexW2078391824MaRDI QIDQ924525
Joshua A. Anderson, Alex Travesset, Christian D. Lorenz
Publication date: 16 May 2008
Published in: Journal of Computational Physics (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1016/j.jcp.2008.01.047
molecular dynamicsgraphics processing unitgraphic processing units (GPU)polymer systemsNVIDIA CUDA programming environment
Modes of computation (nondeterministic, parallel, interactive, probabilistic, etc.) (68Q10) Statistical mechanics of polymers (82D60) Computer graphics; computational geometry (digital and algorithmic aspects) (68U05) Computational methods for problems pertaining to quantum theory (81-08) Numerical algorithms for specific classes of architectures (65Y10)
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