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In this essay, we investigate some relations between Chemical Reaction Networks (CRN) and Mathematical Epidemiology (ME) and report on several pleasant surprises which we had simply by putting these two topics together. Firstly, we propose…

分子网络 · 定量生物学 2025-05-22 Florin Avram , Rim Adenane , Andrei D. Halanay , Matthew D. Johnston

Mathematical Epidemiology (ME) shares with Chemical Reaction Network Theory (CRNT) the basic mathematical structure of its dynamical systems. Despite this central similarity, methods from CRNT have been seldom applied to solving problems in…

动力系统 · 数学 2024-05-30 Nicola Vassena , Florin Avram , Rim Adenane

Our paper reviews some key concepts in chemical reaction network theory and mathematical epidemiology, and examines their intersection, with three goals. The first is to make the case that mathematical epidemiology (ME), and also related…

动力系统 · 数学 2024-11-05 Florin Avram , Rim Adenane , Mircea Neagu

The historical quest for unifying the concepts and methods of Chemical Reaction Networks theory (CRNT), Mahematical Epidemiology (ME) and ecology has received increased attention in the last years and has led in particular to the…

动力系统 · 数学 2026-03-10 Florin Avram , Rim Adenane , Andrei-Dan Halanay

We aim to study boundary stability and persistence of positive odes in mathematical epidemiology models by importing structural tools from chemical reaction networks. This is largely a review work, which attempts to bring closer together…

动力系统 · 数学 2025-12-16 Florin Avram , Rim Adenane , Lasko Basnarkov , Andras Horvath

The dynamics of a chemical reaction network (CRN) is often modelled under the assumption of mass action kinetics by a system of ordinary differential equations (ODEs) with polynomial right-hand sides that describe the time evolution of…

动力系统 · 数学 2023-01-05 Radek Erban , Hye-Won Kang

Chemical reaction network theory is a field of applied mathematics concerned with modeling chemical systems, and can be used in other contexts such as in systems biology to study cellular signaling pathways or epidemiology to study the…

In this work we present a fast, globally convergent, iterative algorithm for computing the asymptotically stable states of nonlinear large--scale systems of quadratic autonomous Ordinary Differential Equations (ODEs) modeling, e.g., the…

数值分析 · 数学 2023-01-02 Silvia Berra , Alessandro La Torraca , Federico Benvenuto , Sara Sommariva

Well-mixed chemical reaction networks (CRNs) contain many distinct chemical species with copy numbers that fluctuate in correlated ways. While those correlations are typically monitored via Monte Carlo sampling of stochastic trajectories,…

统计力学 · 物理学 2026-01-14 John P. Zima , Schuyler B. Nicholson , Todd R. Gingrich

In this paper, we provide a detailed theoretical analysis of the numerical scheme introduced in J. Comput. Phys. 436 (2021) 110253 for the reaction kinetics of a class of chemical reaction networks that satisfies detailed balance condition.…

数值分析 · 数学 2024-02-07 Chun Liu , Cheng Wang , Yiwei Wang

The localization of bifurcations in large parametric systems is still a challenge where the combination of rigorous criteria and informal intuition is often needed. With this motivation, we address symbolically the Jacobian matrix of…

动力系统 · 数学 2023-11-17 Nicola Vassena

The use of mathematical models has helped to shed light on countless phenomena in chemistry and biology. Often, though, one finds that systems of interest in these fields are dauntingly complex. In this paper, we attempt to synthesize and…

分子网络 · 定量生物学 2007-09-04 Mark Lipson

The stochastic description of chemical reaction networks with the kinetic chemical master equation (CME) is important for studying biological cells, but it suffers from the curse of dimensionality: The amount of data to be stored grows…

数值分析 · 数学 2024-08-02 Lukas Einkemmer , Julian Mangott , Martina Prugger

Across many disciplines, chemical reaction networks (CRNs) are an established population model defined as a system of coupled nonlinear ordinary differential equations. In many applications, for example, in systems biology and epidemiology,…

系统与控制 · 电气工程与系统科学 2023-01-23 Kim G. Larsen , Daniele Toller , Mirco Tribastone , Max Tschaikowski , Andrea Vandin

A chemical reaction network (CRN) is composed of reactions that can be seen as interactions among entities called species, which exist within the system. Endowed with kinetics, CRN has a corresponding set of ordinary differential equations…

动力系统 · 数学 2021-04-20 Bryan S. Hernandez , Ralph John L. De la Cruz

Chemical reaction network theory provides powerful tools for rigorously understanding chemical reactions and the dynamical systems and differential equations that represent them. A frequent issue with mathematical analyses of these networks…

定量方法 · 定量生物学 2025-12-23 Joseph M. Sauder , Bruce P. Ayati , Ryan Kinser

Chemical kinetics and reaction engineering consists of the phenomenological framework for the disentanglement of reaction mechanisms, optimization of reaction performance and the rational design of chemical processes. Here, we utilize…

机器学习 · 计算机科学 2021-12-10 Gabriel S. Gusmão , Adhika P. Retnanto , Shashwati C. da Cunha , Andrew J. Medford

Motivation: A Chemical Reaction Network (CRN) is a set of chemical reactions, which can be very complex and difficult to analyze. Indeed, dynamical properties of CRNs can be described by a set of non-linear differential equations that…

计算工程、金融与科学 · 计算机科学 2021-07-02 Lucia Nasti , Roberta Gori , Paolo Milazzo , Federico Poloni

Stochastic evolution of Chemical Reactions Networks (CRNs) over time is usually analysed through solving the Chemical Master Equation (CME) or performing extensive simulations. Analysing stochasticity is often needed, particularly when some…

计算机科学中的逻辑 · 计算机科学 2015-09-11 Luca Laurenti , Luca Cardelli , Marta Kwiatkowska

The quasi-steady state approximation and time-scale separation are commonly applied methods to simplify models of biochemical reaction networks based on ordinary differential equations (ODEs). The concentrations of the "fast" species are…

动力系统 · 数学 2016-05-10 Meritxell Sáez , Carsten Wiuf , Elisenda Feliu
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