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What makes a reaction network "chemical"?

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第一作者： Stefan,Müller

第一单位： Faculty of Mathematics, University of Vienna, Oskar-Morgenstern-Platz 1, 1090, Vienna, Austria.

作者： Stefan,Müller ^[1] ; Christoph,Flamm ^[2] ; Peter F,Stadler ^[3]

作者单位： Faculty of Mathematics, University of Vienna, Oskar-Morgenstern-Platz 1, 1090, Vienna, Austria. ^[1] Department of Theoretical Chemistry, University of Vienna, Währinger Straße 17, 1090, Vienna, Austria. ^[2] Department of Theoretical Chemistry, University of Vienna, Währinger Straße 17, 1090, Vienna, Austria. studla@bioinf.uni-leipzig.de.;Bioinformatics Group, Department of Computer Science, and Interdisciplinary Center for Bioinformatics, Universität Leipzig, Härtelstraße 16-18, 04107, Leipzig, Germany. studla@bioinf.uni-leipzig.de.;German Centre for Integrative Biodiversity Research (iDiv) Halle-Jena-Leipzig & Competence Center for Scalable Data Services and Solutions Dresden-Leipzig & Leipzig Research Center for Civilization Diseases University Leipzig, 04107, Leipzig, Germany. studla@bioinf.uni-leipzig.de.;Max Planck Institute for Mathematics in the Sciences, Inselstraße 22, 04103, Leipzig, Germany. studla@bioinf.uni-leipzig.de.;Faculdad de Ciencias, Universidad Nacional de Colombia, Sede Bogotá, Ciudad Universitaria, Bogotá, 111321, Colombia. studla@bioinf.uni-leipzig.de.;Santa Fe Institute, 1399 Hyde Park Rd., Santa Fe, NM87501, USA. studla@bioinf.uni-leipzig.de. ^[3]

关键词 Chemical reaction network Directed hypergraph Energy conservation Futile cycle Lewis formula Mass conservation Multigraph Null spaces Perpetuum mobile Reaction invariants Stoichiometric matrix Sum formula

DOI 10.1186/s13321-022-00621-8

PMID 36123755

发布时间 2025-05-30

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