chemical reaction network theory
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2021 ◽  
Vol 8 (1) ◽  
pp. 49
Author(s):  
Petar Chernev

In the present work we give an overview and implementation of an algorithm for building and integrating dynamic systems from reaction networks. Reaction networks have their roots in chemical reaction network theory, but their nature is general enough that they can be applied in many fields to model complex interactions. Our aim is to provide a simple to use program that allows for quick prototyping of dynamic models based on a system of reactions. After introducing the concept of a reaction and a reaction network in a general way, not necessarily connected to chemistry, we outlay the algorithm for building its associated system of ODEs. Finally, we give a few example usages where we examine a range of growth-decay models in the context of reaction networks.


2021 ◽  
Vol 0 (0) ◽  
pp. 0
Author(s):  
Ross Cressman ◽  
Vlastimil Křivan

<p style='text-indent:20px;'>This article shows how to apply results of chemical reaction network theory (CRNT) to prove uniqueness and stability of a positive equilibrium for pairs/groups distributional dynamics that arise in game theoretic models. Evolutionary game theory assumes that individuals accrue their fitness through interactions with other individuals. When there are two or more different strategies in the population, this theory assumes that pairs (groups) are formed instantaneously and randomly so that the corresponding pairs (groups) distribution is described by the Hardy–Weinberg (binomial) distribution. If interactions times are phenotype dependent the Hardy-Weinberg distribution does not apply. Even if it becomes impossible to calculate the pairs/groups distribution analytically we show that CRNT is a general tool that is very useful to prove not only existence of the equilibrium, but also its stability. In this article, we apply CRNT to pair formation model that arises in two player games (e.g., Hawk-Dove, Prisoner's Dilemma game), to group formation that arises, e.g., in Public Goods Game, and to distribution of a single population in patchy environments. We also show by generalizing the Battle of the Sexes game that the methodology does not always apply.</p>


J ◽  
2019 ◽  
Vol 2 (3) ◽  
pp. 384-409
Author(s):  
Sourav Mondal ◽  
Nilanjan De ◽  
Anita Pal

Topological indices are numeric quantities that describes the topology of molecular structure in mathematical chemistry. An important area of applied mathematics is the chemical reaction network theory. Real-world problems can be modeled using this theory. Due to its worldwide applications, chemical networks have attracted researchers since their foundation. In this report, some silicate and oxide networks are studied, and exact expressions of some newly-developed neighborhood degree-based topological indices named as the neighborhood Zagreb index ( M N ), the neighborhood version of the forgotten topological index ( F N ), the modified neighborhood version of the forgotten topological index ( F N ∗ ), the neighborhood version of the second Zagreb index ( M 2 ∗ ), and neighborhood version of the hyper Zagreb index ( H M N ) are obtained for the aforementioned networks. In addition, a comparison among all the indices is shown graphically.


Open Physics ◽  
2017 ◽  
Vol 15 (1) ◽  
pp. 1015-1021 ◽  
Author(s):  
Muhammad Saeed Ahmad ◽  
Waqas Nazeer ◽  
Shin Min Kang ◽  
Muhammad Imran ◽  
Wei Gao

AbstractAn important area of applied mathematics is the Chemical reaction network theory. The behavior of real world problems can be modeled by using this theory. Due to applications in theoretical chemistry and biochemistry, it has attracted researchers since its foundation. It also attracts pure mathematicians because it involves interesting mathematical structures. In this report, we compute newly defined topological indices, namely, Arithmetic-Geometric index (AG1index),SKindex,SK1index, andSK2index of the dominating David derived networks [1, 2, 3, 4, 5].


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