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Stoichiometric network analysis of a reaction system with conservation constraints
dc.creator | Čupić, Željko | |
dc.creator | Macesic, Stevan | |
dc.creator | Novaković, Katarina | |
dc.creator | Anić, Slobodan | |
dc.creator | Kolar-Anić, Ljiljana | |
dc.date.accessioned | 2019-01-30T18:00:20Z | |
dc.date.available | 2019-08-17 | |
dc.date.issued | 2018 | |
dc.identifier.issn | 1054-1500 | |
dc.identifier.uri | https://cer.ihtm.bg.ac.rs/handle/123456789/2431 | |
dc.description.abstract | Stoichiometric Network Analysis (SNA) is a powerful method that can be used to examine instabilities in modelling a broad range of reaction systems without knowing the explicit values of reaction rate constants. Due to a lack of understanding, SNA is rarely used and its full potential is not yet fulfilled. Using the oscillatory carbonylation of a polymeric substrate [poly(ethylene glycol) methyl ether acetylene] as a case study, in this work, we consider two mathematical methods for the application of SNA to the reaction models when conservation constraints between species have an important role. The first method takes conservation constraints into account and uses only independent intermediate species, while the second method applies to the full set of intermediate species, without the separation of independent and dependent variables. Both methods are used for examination of steady state stability by means of a characteristic polynomial and related Jacobian matrix. It was shown that both methods give the same results. Therefore, as the second method is simpler, we suggest it as a more straightforward method for the applications. Published by AIP Publishing. | en |
dc.publisher | Amer Inst Physics, Melville | |
dc.relation | UK Engineering and Physical Sciences Research Council (EPSRC) - EP/N033655/1 | |
dc.relation | info:eu-repo/grantAgreement/MESTD/Basic Research (BR or ON)/172015/RS// | |
dc.relation | info:eu-repo/grantAgreement/MESTD/Integrated and Interdisciplinary Research (IIR or III)/45001/RS// | |
dc.rights | embargoedAccess | |
dc.source | Chaos | |
dc.title | Stoichiometric network analysis of a reaction system with conservation constraints | en |
dc.type | article | |
dc.rights.license | ARR | |
dcterms.abstract | Новаковиц, Катарина; Колар-Aниц, Љиљана; Чупић, Жељко; Мацесиц, Стеван; Aниц, Слободан; | |
dc.citation.volume | 28 | |
dc.citation.issue | 8 | |
dc.citation.spage | 083114 | |
dc.citation.other | 28(8): | |
dc.citation.rank | aM21 | |
dc.identifier.pmid | 30180608 | |
dc.identifier.doi | 10.1063/1.5026791 | |
dc.identifier.fulltext | https://cer.ihtm.bg.ac.rs/bitstream/id/14431/chaos.pdf | |
dc.identifier.scopus | 2-s2.0-85052325290 | |
dc.identifier.wos | 000443760700019 | |
dc.type.version | publishedVersion |