Modeling of chemical reaction systems with detailed balance using gradient structures
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Publication:2659345
Abstract: We consider various modeling levels for spatially homogeneous chemical reaction systems, namely the chemical master equation, the chemical Langevin dynamics, and the reaction-rate equation. Throughout we restrict our study to the case where the microscopic system satisfies the detailed-balance condition. The latter allows us to enrich the systems with a gradient structure, i.e. the evolution is given by a gradient-flow equation. We present the arising links between the associated gradient structures that are driven by the relative entropy of the detailed-balance steady state. The limit of large volumes is studied in the sense of evolutionary -convergence of gradient flows. Moreover, we use the gradient structures to derive hybrid models for coupling different modeling levels.
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Cited in
(16)- Kinetic equations for processes on co-evolving networks
- Computational mean-field information dynamics associated with reaction-diffusion equations
- A Route to the Hydrodynamic Limit of a Reaction-Diffusion Master Equation Using Gradient Structures
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- GENERIC framework for reactive fluid flows
- EDP-convergence for nonlinear fast-slow reaction systems with detailed balance
- Coarse-graining via EDP-convergence for linear fast-slow reaction systems
- GENERIC for dissipative solids with bulk-interface interaction
- Cosh gradient systems and tilting
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