Coclique level structure for stochastic chemical reaction networks

Continuous time Markov chains are commonly used as models for the stochastic behavior of chemical reaction networks. More precisely, these Stochastic Chemical Reaction Networks (SCRNs) are frequently used to gain a mechanistic understanding of how chemical reaction rate parameters impact the stochastic behavior of these systems. One property of interest is mean first passage times (MFPTs) between states. However, deriving explicit formulas for MFPTs can be highly complex. In order to address this problem, we first introduce the concept of [Formula: see text] and develop theorems to determine whether certain SCRNs have this feature by studying associated graphs. Additionally, we develop an algorithm to identify, under specific assumptions, all possible coclique level structures associated with a given SCRN. Finally, we demonstrate how the presence of such a structure in a SCRN allows us to derive closed form formulas for both upper and lower bounds for the MFPTs. Our methods can be applied to SCRNs taking values in a generic finite state space and can also be applied to models with non-mass-action kinetics. We illustrate our results with examples from the biological areas of epigenetics, neurobiology and ecology.

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Publication Details

Journal
Journal of Mathematical Biology
Published
2025-11-10
DOI
https://doi.org/10.1007/s00285-025-02261-6
Primary Topic
Gene Regulatory Network Analysis
Type
article
Field-Weighted Citation Impact
0.00

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article

Coclique level structure for stochastic chemical reaction networks

Ruth Williams, Yi Fu, Domitilla Del Vecchio, Simone Bruno et al.
Journal of Mathematical Biology
Gene Regulatory Network Analysis
article

Coclique level structure for stochastic chemical reaction networks

Ruth Williams, Yi Fu, Domitilla Del Vecchio, Simone Bruno, Felipe A. Campos
article en

Abstract

Continuous time Markov chains are commonly used as models for the stochastic behavior of chemical reaction networks. More precisely, these Stochastic Chemical Reaction Networks (SCRNs) are frequently used to gain a mechanistic understanding of how chemical reaction rate parameters impact the stochastic behavior of these systems. One property of interest is mean first passage times (MFPTs) between states. However, deriving explicit formulas for MFPTs can be highly complex. In order to address this problem, we first introduce the concept of [Formula: see text] and develop theorems to determine whether certain SCRNs have this feature by studying associated graphs. Additionally, we develop an algorithm to identify, under specific assumptions, all possible coclique level structures associated with a given SCRN. Finally, we demonstrate how the presence of such a structure in a SCRN allows us to derive closed form formulas for both upper and lower bounds for the MFPTs. Our methods can be applied to SCRNs taking values in a generic finite state space and can also be applied to models with non-mass-action kinetics. We illustrate our results with examples from the biological areas of epigenetics, neurobiology and ecology.

Journal of Mathematical BiologyVol. 91(6)
University of California San Diego (US), Dana-Farber Cancer Institute (US), Massachusetts Institute of Technology (US)
National Science Foundation, Charles Lee Powell Foundation
Openalex Percentile: Top 70%
Gene Regulatory Network Analysis
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Coclique level structure for stochastic chemical reaction networks — Ruth Williams, Yi Fu, et al. · Journal of Mathematical Biology (2025) | TGRS Research Map | TGRS