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Achieving Scalable Parallel Molecular Dynamics Using Dynamic Spatial Domain Decomposition Techniques (1997)  (Make Corrections)  (1 citation)
Lars Nyland, Jan PRINS, RU HUAI YUN, JAN HERMANS, HYE-CHUNG KUM, LEI WANG
Journal of Parallel and Distributed Computing



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Abstract: . To achieve scalable parallel performance in Molecular Dynamics Simulations, we have modeled and implemented several dynamic spatial domain decomposition algorithms. The modeling is based upon the Bulk Synchronous Parallel architecture model (BSP), which describes supersteps of computation, communication, and synchronization. Using this model, we have developed prototypes that explore the differing costs of several spatial decomposition algorithms, and then use this data to drive... (Update)

Context of citations to this paper:   More

.... and second, when remote data must be retrieved, it is very likely that it will be used many times, amortizing the cost of remote access [19]. Figure 6 shows scaling characteristics of a parallel version of Sigma on the SGI O2000. The graph shows performance on two different...

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BibTeX entry:   (Update)

L. Nyland, J. Prins, R.H. Yun, J. Hermans, H.-C. Kum, L. Wang, "Achieving Scalable Parallel Molecular Dynamics Using Domain Decomposition Techniques", Journal of Parallel and Distributed Computing 47(2):125--138, 1997. http://citeseer.ist.psu.edu/nyland97achieving.html   More

@article{ nyland97achieving,
    author = "Lars Nyland and Jan Prins and Ru Huai Yun and Jan Hermans and Hye-Chung Kum and Lei Wang",
    title = "Achieving Scalable Parallel Molecular Dynamics Using Dynamic Spatial Domain Decomposition Techniques",
    journal = "Journal of Parallel and Distributed Computing",
    volume = "47",
    number = "2",
    pages = "125--138",
    year = "1997",
    url = "citeseer.ist.psu.edu/nyland97achieving.html" }
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2   AMBER -- molecular dynamics (context) - Case, Greenberg et al. - 1995
2   An Initial Proposal for the BSP Worldwide Standard Library (context) - Hill, McColl
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