Stochastic simulation algorithms for computational systems biology: Exact, approximate, and hybrid methods

G Simoni, F Reali, C Priami… - … : Systems Biology and …, 2019 - Wiley Online Library
Nowadays, mathematical modeling is playing a key role in many different research fields. In
the context of system biology, mathematical models and their associated computer …

Catalyst: Fast and flexible modeling of reaction networks

TE Loman, Y Ma, V Ilin, S Gowda… - PLOS Computational …, 2023 - journals.plos.org
We introduce Catalyst. jl, a flexible and feature-filled Julia library for modeling and high-
performance simulation of chemical reaction networks (CRNs). Catalyst supports simulating …

[HTML][HTML] An overview of network-based and-free approaches for stochastic simulation of biochemical systems

A Gupta, P Mendes - Computation, 2018 - mdpi.com
Stochastic simulation has been widely used to model the dynamics of biochemical reaction
networks. Several algorithms have been proposed that are exact solutions of the chemical …

Catalyst: fast biochemical modeling with Julia

TE Loman, Y Ma, V Ilin, S Gowda, N Korsbo, N Yewale… - bioRxiv, 2022 - biorxiv.org
We introduce Catalyst. jl, a flexible and feature-filled Julia library for modeling and high
performance simulation of chemical reaction networks (CRNs). Catalyst acts as both a …

Simulation of biochemical reactions with time-dependent rates by the rejection-based algorithm

VH Thanh, C Priami - The Journal of chemical physics, 2015 - pubs.aip.org
We address the problem of simulating biochemical reaction networks with time-dependent
rates and propose a new algorithm based on our rejection-based stochastic simulation …

[Књига][B] Simulation algorithms for computational systems biology

L Marchetti, C Priami, VH Thanh - 2017 - Springer
The dynamics of molecular systems is an essential tool of systems biology. It helps figuring
out what is the effect of the perturbation of a system, or what is the best dose for a drug or …

Snoopy's hybrid simulator: a tool to construct and simulate hybrid biological models

M Herajy, F Liu, C Rohr, M Heiner - BMC systems biology, 2017 - Springer
Background Hybrid simulation of (computational) biochemical reaction networks, which
combines stochastic and deterministic dynamics, is an important direction to tackle future …

HRSSA–Efficient hybrid stochastic simulation for spatially homogeneous biochemical reaction networks

L Marchetti, C Priami, VH Thanh - Journal of Computational Physics, 2016 - Elsevier
This paper introduces HRSSA (Hybrid Rejection-based Stochastic Simulation Algorithm), a
new efficient hybrid stochastic simulation algorithm for spatially homogeneous biochemical …

[HTML][HTML] Parameter estimation for the reaction–diffusion master equation

D Barrows, S Ilie - AIP Advances, 2023 - pubs.aip.org
In this paper, we present a novel method to estimate chemical reaction and diffusion rates
for biochemical reaction–diffusion dynamics from a time series of observations. Our …

Efficient constant-time complexity algorithm for stochastic simulation of large reaction networks

VH Thanh, R Zunino, C Priami - IEEE/ACM transactions on …, 2016 - ieeexplore.ieee.org
Exact stochastic simulation is an indispensable tool for a quantitative study of biochemical
reaction networks. The simulation realizes the time evolution of the model by randomly …