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相关论文: On hybrid simulation schemes for stochastic reacti…

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We discuss a method to describe the qualitative dynamics of chemical reaction networks in terms of symbolic dynamics. The method, that can be applied to mass-action reaction networks with separated timescales, uses solutions of the partial…

分子网络 · 定量生物学 2022-05-17 Aurélien Desoeuvres , Peter Szmolyan , Ovidiu Radulescu

Stochastic models in which agents interact with their neighborhood according to a network topology are a powerful modeling framework to study the emergence of complex dynamic patterns in real-world systems. Stochastic simulations are often…

社会与信息网络 · 计算机科学 2021-01-27 Gerrit Großmann , Luca Bortolussi , Verena Wolf

We present the spatial regime conversion method (SRCM), a novel hybrid modelling framework for simulating reaction-diffusion systems that adaptively combines stochastic discrete and deterministic continuum representations. Extending the…

定量方法 · 定量生物学 2025-07-08 Charles G. Cameron , Cameron A. Smith , Christian A. Yates

Traditional chemical kinetics may be inappropriate to describe chemical reactions in micro-domains involving only a small number of substrate and reactant molecules. Starting with the stochastic dynamics of the molecules, we derive a…

数学物理 · 物理学 2009-11-10 D. Holcman , Z. Schuss

In biophysics, the search for analytical solutions of stochastic models of cellular processes is often a challenging task. In recent work on models of gene expression, it was shown that a mapping based on partitioning of Poisson arrivals…

生物物理 · 物理学 2018-05-09 Hugo Tschirhart , Thierry Platini

Noise-assisted transport phenomena highlight the nontrivial interplay between environmental effects and quantum coherence in achieving maximal efficiency. Due to the complexity of biochemical systems and their environments, effective open…

Chemical reaction networks (CRNs) provide a convenient language for modelling a broad variety of biological systems. These models are commonly studied with respect to the time series they generate in deterministic or stochastic simulations.…

分子网络 · 定量生物学 2019-07-11 Ozan Kahramanoğulları

We develop a provably efficient importance sampling scheme that estimates exit probabilities of solutions to small-noise stochastic reaction-diffusion equations from scaled neighborhoods of a stable equilibrium. The moderate deviation…

概率论 · 数学 2023-10-24 Ioannis Gasteratos , Michael Salins , Konstantinos Spiliopoulos

We present three algorithms for calculating rate constants and sampling transition paths for rare events in simulations with stochastic dynamics. The methods do not require a priori knowledge of the phase space density and are suitable for…

软凝聚态物质 · 物理学 2009-11-11 Rosalind J. Allen , Daan Frenkel , Pieter Rein ten Wolde

We present a method for enhanced sampling of molecular dynamics simulations using stochastic resetting. Various phenomena, ranging from crystal nucleation to protein folding, occur on timescales that are unreachable in standard simulations.…

化学物理 · 物理学 2023-02-09 Ofir Blumer , Shlomi Reuveni , Barak Hirshberg

Many time series are effectively generated by a combination of deterministic continuous flows along with discrete jumps sparked by stochastic events. However, we usually do not have the equation of motion describing the flows, or how they…

机器学习 · 计算机科学 2020-01-09 Junteng Jia , Austin R. Benson

Stochastic differential equations (SDEs) provide a natural framework for modelling intrinsic stochasticity inherent in many continuous-time physical processes. When such processes are observed in multiple individuals or experimental units,…

统计计算 · 统计学 2016-05-19 Gavin A. Whitaker , Andrew Golightly , Richard J. Boys , Chris Sherlock

Stochastic reaction network models are widely utilized in biology and chemistry to describe the probabilistic dynamics of biochemical systems in general, and gene interaction networks in particular. Most often, statistical analysis and…

定量方法 · 定量生物学 2017-10-18 Eugenio Cinquemani

Quasi-Monte Carlo methods have proven to be effective extensions of traditional Monte Carlo methods in, amongst others, problems of quadrature and the sample path simulation of stochastic differential equations. By replacing the random…

定量方法 · 定量生物学 2019-12-12 Casper H. L. Beentjes , Ruth E. Baker

Molecular dynamics simulations are widely used across chemistry, physics, and biology, providing quantitative insight into complex processes with atomic detail. However, their limited timescale of a few microseconds is a significant…

化学物理 · 物理学 2025-04-10 Ofir Blumer , Barak Hirshberg

Complex systems are composed of many particles or agents that move and interact with one another. The underlying mathematical framework to model many of these systems must incorporate the spatial transport of particles and their…

统计力学 · 物理学 2026-02-09 Mauricio J. del Razo , Tommaso Lamma , Wout Merbis

Reaction networks are widely used models to describe biochemical processes. Stochastic fluctuations in the counts of biological macromolecules have amplified consequences due to their small population sizes. This makes it necessary to favor…

概率论 · 数学 2022-02-28 Daniele Cappelletti , Badal Joshi

Stochastic dynamical systems arise naturally across nearly all areas of science and engineering. Typically, a dynamical system model is based on some prior knowledge about the underlying dynamics of interest in which probabilistic features…

计算工程、金融与科学 · 计算机科学 2021-09-03 Chao Yin , Xihaier Luo , Ahsan Kareem

Stochastic processes have found numerous applications in science, as they are broadly used to model a variety of natural phenomena. Due to their intrinsic randomness and uncertainty, they are, however, difficult to characterize. Here, we…

This paper analyses of a stochastic model of a chemical reaction network with three types of chemical species ${\cal R}$, ${\cal M}$ and ${\cal U}$ that interact to transform a flow of external resources, the chemical species ${\cal Q}$, to…

概率论 · 数学 2025-12-01 Vincent Fromion , Philippe Robert , Jana Zaherddine