Geometry and symmetry in biochemical reaction systems.

IF 17.7 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Accounts of Chemical Research Pub Date : 2021-10-01 Epub Date: 2021-07-15 DOI:10.1007/s12064-021-00353-7
Raffaella Mulas, Rubén J Sánchez-García, Ben D MacArthur
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Abstract

Complex systems of intracellular biochemical reactions have a central role in regulating cell identities and functions. Biochemical reaction systems are typically studied using the language and tools of graph theory. However, graph representations only describe pairwise interactions between molecular species and so are not well suited to modelling complex sets of reactions that may involve numerous reactants and/or products. Here, we make use of a recently developed hypergraph theory of chemical reactions that naturally allows for higher-order interactions to explore the geometry and quantify functional redundancy in biochemical reactions systems. Our results constitute a general theory of automorphisms for oriented hypergraphs and describe the effect of automorphism group structure on hypergraph Laplacian spectra.

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生化反应系统中的几何学和对称性。
复杂的细胞内生化反应系统在调节细胞特性和功能方面发挥着核心作用。生化反应系统通常使用图论语言和工具进行研究。然而,图表示法只能描述分子物种之间成对的相互作用,因此不太适合模拟可能涉及大量反应物和/或产物的复杂反应集。在这里,我们利用最近开发的化学反应超图理论,自然地允许高阶相互作用,来探索生化反应系统的几何形状并量化功能冗余。我们的研究成果构成了面向超图的一般自动形态理论,并描述了自动形态群结构对超图拉普拉斯谱的影响。
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来源期刊
Accounts of Chemical Research
Accounts of Chemical Research 化学-化学综合
CiteScore
31.40
自引率
1.10%
发文量
312
审稿时长
2 months
期刊介绍: Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance. Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.
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