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Computing Linearly Conjugate Weakly Reversible Kinetic Structures Using Optimization and Graph Theory

  • Metaadatok
Tartalom: http://real.mtak.hu/39564/
Archívum: MTA Könyvtár
Gyűjtemény: Status = Published
Type = Article
Cím:
Computing Linearly Conjugate Weakly Reversible Kinetic Structures Using Optimization and Graph Theory
Létrehozó:
Ács, Bernadett
SzederkĂŠnyi, GĂĄbor
Tuza, ZoltĂĄn AndrĂĄs
Tuza, Zsolt
Kiadó:
Institut fĂźr Strahlenchemie, Max-Planck-Institut fĂźr Kohlenforschung
Dátum:
2015
Téma:
QA166-QA166.245 Graphs theory / grĂĄfelmĂŠlet
Tartalmi leírás:
A graph-theory-based algorithm is given in this paper for computing dense weakly reversible linearly conjugate realizations of kinetic systems using a fixed set of complexes. The algorithm is also able to decide whether such a realization exists or not. To prove the correctness of the method, it is shown that weakly reversible linearly conjugate chemical reaction network realizations containing the maximum number of directed edges form a unique super-structure among all linearly conjugate weakly reversible realizations. An illustrative example taken from the literature is used to show the operation of the algorithm.
Nyelv:
angol
Típus:
Article
PeerReviewed
info:eu-repo/semantics/article
Formátum:
text
Azonosító:
Ács, Bernadett and SzederkÊnyi, Gåbor and Tuza, Zoltån Andrås and Tuza, Zsolt (2015) Computing Linearly Conjugate Weakly Reversible Kinetic Structures Using Optimization and Graph Theory. MATCH-COMMUNICATIONS IN MATHEMATICAL AND IN COMPUTER CHEMISTRY, 74 (3). pp. 481-504. ISSN 0340-6253
Kapcsolat:
MTMT:2933020