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August 30, 1999Physical Review Letters157 citationsOpen Access

From Molecular Dynamics to Dissipative Particle Dynamics

EFEirik G. FlekkøyPCPeter V. Coveney

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Abstract

A procedure is introduced for deriving a coarse-grained dissipative particle dynamics from molecular dynamics. The rules of the dissipative particle dynamics are derived from the underlying molecular interactions, and a Langevin equation is obtained that describes the forces experienced by the dissipative particles and specifies the associated canonical Gibbs distribution for the system.

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Flekkøy et al. (1999) studied this question.

synapsesocial.com/papers/6a5cb00cbcb839ae37c50b18https://doi.org/10.1103/physrevlett.83.1775
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