Titlebook: Bridging the Time Scales; Molecular Simulation Peter Nielaba,Michel Mareschal,Giovanni Ciccotti Book 2002 Springer-Verlag Berlin Heidelberg

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Der Turnaround bei der Weberei Tuch GmbHucleated ensemble is energetically very close to equilibrium; slow relaxation is still observed. At lower temperatures, sidechain relaxation becomes a significant and very noticeable part of the folding reaction.

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https://doi.org/10.1007/978-3-8349-6935-4l simulations, the Coulomb and dipole-dipole interactions are taken into account in such a way that the specific physical properties which derive from their slow decrease and infinite range stay preserved.

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Numerical Simulations of Molecular Systems with Long Range Interactionsl simulations, the Coulomb and dipole-dipole interactions are taken into account in such a way that the specific physical properties which derive from their slow decrease and infinite range stay preserved.

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A Statistical Mechanical Theory of Quantum Dynamics in Classical Environments the two isolated subsystems but also describes their interaction. [.,.,.] The most widely used approaches are based on surface-hopping schemes where the coupling between the two subsystems induces quantum transitions. [.,.,.,.]

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Book 2002dynamics or Monte Carlo simulation techniques. As progress is coming more through refined simulation methods than from increased computer power, this volume is intended as both an introduction and a review of all relevant modern methods that will shape molecular simulation in the forthcoming decade.