Results 31 to 40 of about 254,055 (254)

On the Complexity of Reconstructing Chemical Reaction Networks [PDF]

open access: yesMathematics in Computer Science, 2013
The analysis of the structure of chemical reaction networks is crucial for a better understanding of chemical processes. Such networks are well described as hypergraphs. However, due to the available methods, analyses regarding network properties are typically made on standard graphs derived from the full hypergraph description, e.g.\ on the so-called ...
Rolf Fagerberg   +4 more
openaire   +4 more sources

Timing in chemical reaction networks [PDF]

open access: yesProceedings of the Twenty-Fifth Annual ACM-SIAM Symposium on Discrete Algorithms, 2013
Chemical reaction networks (CRNs) formally model chemistry in a well-mixed solution. CRNs are widely used to describe information processing occurring in natural cellular regulatory networks, and with upcoming advances in synthetic biology, CRNs are a promising programming language for the design of artificial molecular control circuitry.
openaire   +3 more sources

Linear stability analysis of chemical mechanism, Listanalchem: A tool for the search of spontaneous mirror symmetry breaking

open access: yesMethodsX, 2023
Homochirality, the phenomenon by which one of two virtually identical (non-superimposable mirror images) compounds is favored over the other in the chemistry of life, has been regarded as a requisite for the emergence of all living things on earth ...
Elkin Cruz   +2 more
doaj   +1 more source

Synchronization of Chemical Reaction Networks Based on DNA Strand Displacement Circuits

open access: yesIEEE Access, 2018
Reversible bimolecular chemical reactions are elementary chemical reactions. This paper investigated this reaction type based on DNA strand displacement, and proposed degradation, catalysis, and annihilation reactions along with the synchronization ...
Chengye Zou   +3 more
doaj   +1 more source

Computing with chemical reaction networks: a tutorial [PDF]

open access: yesNatural Computing, 2019
Chemical reaction networks (CRNs) model the behavior of chemical reactions in well-mixed solutions and they can be designed to perform computations. In this tutorial we give an overview of various computational models for CRNs. Moreover, we discuss a method to implement arbitrary (abstract) CRNs in a test tube using DNA.
openaire   +4 more sources

Families of toric chemical reaction networks [PDF]

open access: yesJournal of Mathematical Chemistry, 2020
AbstractWe study families of chemical reaction networks whose positive steady states are toric, and therefore can be parameterized by monomials. Families are constructed algorithmically from a core network; we show that if a family member is multistationary, then so are all subsequent networks in the family.
Michael F. Adamer, Martin Helmer
openaire   +3 more sources

The GRETOBAPE Gas-phase Reaction Network: The Importance of Being Exothermic

open access: yesThe Astrophysical Journal Supplement Series, 2023
The gas-phase reaction networks are the backbone of astrochemical models. However, due to their complexity and nonlinear impact on the astrochemical modeling, they can be the first source of error in the simulations if incorrect reactions are present ...
Lorenzo Tinacci   +7 more
doaj   +1 more source

A network dynamics approach to chemical reaction networks [PDF]

open access: yesInternational Journal of Control, 2015
A crisp survey is given of chemical reaction networks from the perspective of general nonlinear network dynamics, in particular of consensus dynamics. It is shown how by starting from the complex-balanced assumption the reaction dynamics governed by mass action kinetics can be rewritten into a form which allows for a very simple derivation of a number ...
A. J. van der Schaft   +2 more
openaire   +2 more sources

Concordant chemical reaction networks and the Species-Reaction Graph [PDF]

open access: yesMathematical Biosciences, 2013
In a recent paper it was shown that, for chemical reaction networks possessing a subtle structural property called concordance, dynamical behavior of a very circumscribed (and largely stable) kind is enforced, so long as the kinetics lies within the very broad and natural weakly monotonic class.
Shinar, Guy, Feinberg, Martin
openaire   +3 more sources

A deep learning framework for accurate reaction prediction and its application on high-throughput experimentation data

open access: yesJournal of Cheminformatics, 2023
In recent years, it has been seen that artificial intelligence (AI) starts to bring revolutionary changes to chemical synthesis. However, the lack of suitable ways of representing chemical reactions and the scarceness of reaction data has limited the ...
Baiqing Li   +8 more
doaj   +1 more source

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