[PDF][PDF] Simplification of mathematical models of chemical reaction systems
MS Okino, ML Mavrovouniotis - Chemical reviews, 1998 - Citeseer
Detailed modeling of complex reaction systems is becoming increasingly important in the
development, analysis, design, and control of chemical reaction processes. For industrial …
development, analysis, design, and control of chemical reaction processes. For industrial …
Michaelis-Menten kinetics at high enzyme concentrations
AR Tzafriri - Bulletin of mathematical biology, 2003 - Springer
The total quasi-steady state approximation (tQSSA) for the irreversible Michaelis-Menten
scheme is derived in a consistent manner. It is found that self-consistency of the initial …
scheme is derived in a consistent manner. It is found that self-consistency of the initial …
Invariant manifold methods for metabolic model reduction
MR Roussel, SJ Fraser - Chaos: An Interdisciplinary Journal of …, 2001 - pubs.aip.org
After the decay of transients, the behavior of a set of differential equations modeling a
chemical or biochemical system generally rests on a low-dimensional surface which is an …
chemical or biochemical system generally rests on a low-dimensional surface which is an …
The effect of lumping and expanding on kinetic differential equations
Let us consider the differential equation ̇\bfy(t)=\bff(\bfy(t)) with an \bff from \bfR^N to \bfR^N
and suppose that there exists a transformation \bfh from \bfR^N to \bfR^̂N (̂N≤N) such …
and suppose that there exists a transformation \bfh from \bfR^N to \bfR^̂N (̂N≤N) such …
A general analysis of exact nonlinear lumping in chemical kinetics
A general analysis of exact nonlinear lumping is presented. This analysis can be applied to
the kinetics of any reaction system with n species described by a set of first-order ordinary …
the kinetics of any reaction system with n species described by a set of first-order ordinary …
Enzyme kinetics far from the standard quasi-steady-state and equilibrium approximations
Analytic approximations of the time-evolution of the single enzyme-substrate reaction are
valid for all but a small region of parameter space in the positive initial enzyme-initial …
valid for all but a small region of parameter space in the positive initial enzyme-initial …
Kinetic modeling of large‐scale reaction systems
TC Ho - Catalysis reviews, 2008 - Taylor & Francis
This review gives a brief account of basic ideas underlying approaches to analysis and
modeling of large‐scale reaction systems. The emphasis is on model simplification and …
modeling of large‐scale reaction systems. The emphasis is on model simplification and …
The application of the QSSA via reaction lumping for the reduction of complex hydrocarbon oxidation mechanisms
The quasi-steady-state approximation (QSSA) has been widely applied for the purposes of
chemical kinetic model reduction. Although it is essentially a low-order approximation, it can …
chemical kinetic model reduction. Although it is essentially a low-order approximation, it can …
A general analysis of approximate nonlinear lumping in chemical kinetics. I. Unconstrained lumping
A general analysis of approximate nonlinear lumping for a chemical kinetic system
described by an n-dimensional first order ordinary differential equation system dy/dt= f (y) is …
described by an n-dimensional first order ordinary differential equation system dy/dt= f (y) is …
Reduction of chemical kinetics in air pollution modeling
B Sportisse, R Djouad - Journal of Computational Physics, 2000 - Elsevier
We investigate in this article the use of reduction techniques in air pollution modeling. The
reduction of chemical kinetics is performed on the basis of a timescale analysis and of …
reduction of chemical kinetics is performed on the basis of a timescale analysis and of …