Improved estimations of stochastic chemical kinetics by finite-state expansion

نویسندگان

چکیده

Stochastic reaction networks are a fundamental model to describe interactions between species where random fluctuations relevant. The master equation provides the evolution of probability distribution across discrete state space consisting vectors population counts for each species. However, since its exact solution is often elusive, several analytical approximations have been proposed. deterministic rate (DRE) gives macroscopic approximation as compact system differential equations that estimate average populations species, but it may be inaccurate in case nonlinear interaction dynamics. Here we propose finite-state expansion (FSE), an method mediating microscopic and interpretations stochastic network by coupling dynamics chosen subset with mean DRE. An algorithm translates into expanded one represented further distinct This translation exactly preserves dynamics, DRE can interpreted correction original one. effectiveness FSE demonstrated models challenge state-of-the-art techniques due intrinsic noise, multi-scale multi-stability.

برای دانلود رایگان متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

Stochastic Chemical Kinetics

where k is the rate constant. The stochastic approach to chemical kinetics is concerned with modeling chemical reactions in situations where the assumptions underlying equations of this type break down. In order to illustrate this, suppose that the reaction above is occuring in a drop of water of volume V , which contains only a very small number, say 3, of molecules of I. The kinetic equation ...

متن کامل

Stochastic simulation of chemical kinetics.

Stochastic chemical kinetics describes the time evolution of a well-stirred chemically reacting system in a way that takes into account the fact that molecules come in whole numbers and exhibit some degree of randomness in their dynamical behavior. Researchers are increasingly using this approach to chemical kinetics in the analysis of cellular systems in biology, where the small molecular popu...

متن کامل

Solving stochastic chemical kinetics by Metropolis Hastings sampling

This study considers using Metropolis-Hastings algorithm for stochastic simulation of chemical reactions. The proposed method uses SSA (Stochastic Simulation Algorithm) distribution which is a standard method for solving well-stirred chemically reacting systems as a desired distribution. A new numerical solvers based on exponential form of exact and approximate solutions of CME (Chemical Master...

متن کامل

Stochastic chemical kinetics and the total quasi-steady-state assumption: application to the stochastic simulation algorithm and chemical master equation.

Recently the application of the quasi-steady-state approximation (QSSA) to the stochastic simulation algorithm (SSA) was suggested for the purpose of speeding up stochastic simulations of chemical systems that involve both relatively fast and slow chemical reactions [Rao and Arkin, J. Chem. Phys. 118, 4999 (2003)] and further work has led to the nested and slow-scale SSA. Improved numerical eff...

متن کامل

Inference for Stochastic Chemical Kinetics Using Moment Equations and System Size Expansion

Quantitative mechanistic models are valuable tools for disentangling biochemical pathways and for achieving a comprehensive understanding of biological systems. However, to be quantitative the parameters of these models have to be estimated from experimental data. In the presence of significant stochastic fluctuations this is a challenging task as stochastic simulations are usually too time-con...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

ژورنال

عنوان ژورنال: Proceedings of The Royal Society A: Mathematical, Physical and Engineering Sciences

سال: 2021

ISSN: ['1471-2946', '1364-5021']

DOI: https://doi.org/10.1098/rspa.2020.0964