Titlebook: New Horizons of Computational Science; Proceedings of the I T. Ebisuzaki,J. Makino Conference proceedings 2001 Terra Scientific Publishing

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Molecular Dynamics Machine: Highly Parallelized Special-Purpose-Computer for Molecular Dynamics Simnable us to perform a million particles molecular dynamics simulation without truncating the Coulomb force using Ewald method. Its predicted performance in real application is about 30 Tflops and it can calculate 10. time-steps of MD simulation with a million particles in about a day. Total system w

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Molecular Simulations With The MD-Grape Special-Purpose Computer,ence, technology and economics. The causes for this are twofold. First, while a mathematical description or model of a phenomenon is usually possible, the equations arising from such models are often intractable either because they cannot be solved analytically or because the number of variables is

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High Performance Computing in Biophysics: Recent Experiences and Developments of Charmm, performance of one of the most widely known biomolecular simulation codes, CHARMM. Also presented are recent performance results for CHARMM on a variety of hardware platforms including the NIH LoBoS system and the MD-GRAPE special purpose computer.

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Massive Parallelism: the Hardware for Computational Chemistry?, classical mechanical simulations of the dynamical properties of many-atom systems, to the mapping of both structure-activity relationships and reaction synthesis steps. Although chemical theory and insight play important roles in this work, the prediction of physical observables is almost invariabl

娴熟

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E. Athanassoulahigh resolution radio telescopes have made it possible to obtain a detailed mapping of the structure of galaxies other than our own. At the same time, new theor978-94-010-1720-6978-94-010-1718-3Series ISSN 1389-2185

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tnumber their massive counterparts, apparently obeying a power-law distribution. Finally, but with the benefit of doubt, it appears that the idea that the whole process reflects an intrinsic fractal nature was also put forward at the time. With this background in mind, let us now turn to the new eme