Modeling and simulating chemical reactions
DJ Higham - SIAM review, 2008 - SIAM
Many students are familiar with the idea of modeling chemical reactions in terms of ordinary
differential equations. However, these deterministic reaction rate equations are really a …
differential equations. However, these deterministic reaction rate equations are really a …
Kinetic Diagram Analysis: A Python Library for Calculating Steady-State Observables of Biochemical Systems Analytically
Kinetic diagrams are commonly used to represent biochemical systems in order to study
phenomena such as free energy transduction and ion selectivity. While numerical methods …
phenomena such as free energy transduction and ion selectivity. While numerical methods …
Simulation methods in systems biology
DT Gillespie - Formal Methods for Computational Systems Biology …, 2008 - Springer
This chapter reviews the theory of stochastic chemical kinetics and several simulation
methods that are based on that theory. An effort is made to delineate the logical connections …
methods that are based on that theory. An effort is made to delineate the logical connections …
A stochastic Fokker–Planck–Master model for diatomic rarefied gas flows
Abstract The direct simulation Monte Carlo (DSMC) method is widely used for numerical
solutions of the Boltzmann equation. However, the associated computational cost becomes …
solutions of the Boltzmann equation. However, the associated computational cost becomes …
The interplay of intrinsic and extrinsic bounded noises in biomolecular networks
After being considered as a nuisance to be filtered out, it became recently clear that
biochemical noise plays a complex role, often fully functional, for a biomolecular network …
biochemical noise plays a complex role, often fully functional, for a biomolecular network …
Model reconstruction for moment-based stochastic chemical kinetics
A Andreychenko, L Mikeev, V Wolf - ACM Transactions on Modeling and …, 2015 - dl.acm.org
Based on the theory of stochastic chemical kinetics, the inherent randomness of biochemical
reaction networks can be described by discrete-state continuous-time Markov chains …
reaction networks can be described by discrete-state continuous-time Markov chains …
A theoretical foundation for state-transition cohort models in health decision analysis
R Iskandar - PloS one, 2018 - journals.plos.org
Following its introduction over three decades ago, the cohort model has been used
extensively to model population trajectories over time in decision-analytic modeling studies …
extensively to model population trajectories over time in decision-analytic modeling studies …
Chemical Master Equation and Langevin regimes for a gene transcription model
Gene transcription models must take account of intrinsic stochasticity. The Chemical Master
Equation framework is based on modelling assumptions that are highly appropriate for this …
Equation framework is based on modelling assumptions that are highly appropriate for this …
Relating continuous and discrete PEPA models of signalling pathways
N Geisweiller, J Hillston, M Stenico - Theoretical Computer Science, 2008 - Elsevier
PEPA and its semantics have recently been extended to model biological systems. In order
to cope with massive quantities of processes (as is usually the case when considering …
to cope with massive quantities of processes (as is usually the case when considering …
Sparse grids and hybrid methods for the chemical master equation
The direct numerical solution of the chemical master equation (CME) is usually impossible
due to the high dimension of the computational domain. The standard method for solution of …
due to the high dimension of the computational domain. The standard method for solution of …