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arxiv: q-bio/0606006 · v2 · submitted 2006-06-07 · 🧬 q-bio.QM · physics.comp-ph· quant-ph

Spatially Distributed Stochastic Systems: equation-free and equation-assisted preconditioned computation

classification 🧬 q-bio.QM physics.comp-phquant-ph
keywords pdesdistributedspatiallystochasticapproximatecoarse-grainedequation-freemodel
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Spatially distributed problems are often approximately modelled in terms of partial differential equations (PDEs) for appropriate coarse-grained quantities (e.g. concentrations). The derivation of accurate such PDEs starting from finer scale, atomistic models, and using suitable averaging, is often a challenging task; approximate PDEs are typically obtained through mathematical closure procedures (e.g. mean-field approximations). In this paper, we show how such approximate macroscopic PDEs can be exploited in constructing preconditioners to accelerate stochastic simulations for spatially distributed particle-based process models. We illustrate how such preconditioning can improve the convergence of equation-free coarse-grained methods based on coarse timesteppers. Our model problem is a stochastic reaction-diffusion model capable of exhibiting Turing instabilities.

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