Parametric sensitivity analysis for models of reaction networks within interacting compartments

D David F. Anderson (University of Wisconsin-Madison 1 , Madison, Wisconsin 53706,) A Aidan S. Howells (Dipartimento di Scienze Matematiche, Politecnico di Torino 2 , Turin,)

Abstract

Models of reaction networks within interacting compartments (RNIC) are a generalization of stochastic reaction networks. It is most natural to think of the interacting compartments as “cells” that can appear, degrade, split, and even merge, with each cell containing an evolving copy of the underlying stochastic reaction network. Such models have a number of parameters, including those associated with the internal chemical model and those associated with the compartment interactions, and it is natural to want efficient computational methods for the numerical estimation of sensitivities of model statistics with respect to these parameters. Motivated by the extensive work on computational methods for parametric sensitivity analysis in the context of stochastic reaction networks over the past few decades, we provide a number of methods in the basic RNIC setting. Provided methods include the (unbiased) Girsanov transformation method (also called the likelihood ratio method) and a number of coupling methods for the implementation of finite differences, each motivated by methods from previous work related to stochastic reaction networks. We provide several numerical examples comparing the various methods in the new setting. We find that the relative performance of each method is in line with its analog in the “standard” stochastic reaction network setting. We have made all the MATLAB codes used to implement the various methods freely available for download.

Article Details

Volume / Issue Vol. 162, Issue 15
Published April 21, 2025
ISSN 0021-9606
Publisher American Institute of Physics

Journal Info

The Journal of Chemical Physics

American Institute of Physics

ISSN: 0021-9606 Physical Sciences

Authors (2)

D

David F. Anderson

University of Wisconsin-Madison 1 , Madison, Wisconsin 53706,

A

Aidan S. Howells

Dipartimento di Scienze Matematiche, Politecnico di Torino 2 , Turin,