Abstraction-based segmental simulation of reaction networks using adaptive memoization

Abstract Background  Stochastic models are commonly employed in the system and synthetic biology to study the effects of stochastic fluctuations emanating from reactions involving species with low copy-numbers. Many important models feature complex dynamics, involving a state-space explosion, stiffn...

Full description

Saved in:
Bibliographic Details
Main Authors: Martin Helfrich, Roman Andriushchenko, Milan Češka, Jan Křetínský, Štefan Martiček, David Šafránek
Format: Article
Language:English
Published: BMC 2024-11-01
Series:BMC Bioinformatics
Subjects:
Online Access:https://doi.org/10.1186/s12859-024-05966-5
Tags: Add Tag
No Tags, Be the first to tag this record!
Description
Summary:Abstract Background  Stochastic models are commonly employed in the system and synthetic biology to study the effects of stochastic fluctuations emanating from reactions involving species with low copy-numbers. Many important models feature complex dynamics, involving a state-space explosion, stiffness, and multimodality, that complicate the quantitative analysis needed to understand their stochastic behavior. Direct numerical analysis of such models is typically not feasible and generating many simulation runs that adequately approximate the model’s dynamics may take a prohibitively long time. Results  We propose a new memoization technique that leverages a population-based abstraction and combines previously generated parts of simulations, called segments, to generate new simulations more efficiently while preserving the original system’s dynamics and its diversity. Our algorithm adapts online to identify the most important abstract states and thus utilizes the available memory efficiently. Conclusion  We demonstrate that in combination with a novel fully automatic and adaptive hybrid simulation scheme, we can speed up the generation of trajectories significantly and correctly predict the transient behavior of complex stochastic systems.
ISSN:1471-2105