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The challenging problem of conducting fully Bayesian inference for the reaction rate constants governing stochastic kinetic models (SKMs) is considered. Given the challenges underlying this problem, the Markov jump process representation is…

Computation · Statistics 2019-01-10 Andrew Golightly , Emma Bradley , Tom Lowe , Colin S. Gillespie

Recently, an approach known as relaxation has been developed for preserving the correct evolution of a functional in the numerical solution of initial-value problems, using Runge-Kutta methods. We generalize this approach to multistep…

Numerical Analysis · Mathematics 2020-11-26 Hendrik Ranocha , Lajos Lóczi , David I. Ketcheson

We address the stabilization of both classical and quantum systems modeled by jump-diffusion stochastic differential equations using a novel hysteresis switching strategy. Unlike traditional methods that depend on global Lyapunov functions…

Optimization and Control · Mathematics 2025-07-22 Weichao Liang , Gaoyue Guo

We introduce stabilized spline collocation schemes for the numerical solution of nonlinear, hyperbolic conservation laws. A nonlinear, residual-based viscosity stabilization is combined with a projection stabilization-inspired linear…

Numerical Analysis · Mathematics 2023-07-18 Ryan M. Aronson , John A. Evans

Gaseous flows show a diverse set of behaviors on different characteristic scales. Given the coarse-grained modeling in theories of fluids, considerable uncertainties may exist between the flow-field solutions and the real physics. To study…

Computational Physics · Physics 2021-05-05 Tianbai Xiao , Martin Frank

Multirate integration is an increasingly relevant tool that enables scientists to simulate multiphysics systems. Existing multirate methods are designed for equations whose fast and slow variables can be linearly separated using additive or…

Numerical Analysis · Mathematics 2025-04-07 Tommaso Buvoli , Brian K. Tran , Ben S. Southworth

The existing discrete variational derivative method is only second-order accurate and fully implicit. In this paper, we propose a framework to construct an arbitrary high-order implicit (original) energy stable scheme and a second-order…

Numerical Analysis · Mathematics 2022-10-24 Jizu Huang

In this paper, we present a novel class of high-order Runge--Kutta (RK) discontinuous Galerkin (DG) schemes for hyperbolic conservation laws. The new method extends beyond the traditional method of lines framework and utilizes…

Numerical Analysis · Mathematics 2024-02-26 Qifan Chen , Zheng Sun , Yulong Xing

The off-lattice Boltzmann (OLB) method consists of numerical schemes which are used to solve the discrete Boltzmann equation. Unlike the commonly used lattice Boltzmann method, the spatial and time steps are uncoupled in the OLB method. In…

Computational Physics · Physics 2015-05-20 Parthib R. Rao , Laura A. Schaefer

A semi-implicit-explicit (semi-IMEX) Runge-Kutta (RK) method is proposed for the numerical integration of ordinary differential equations (ODEs) of the form $\mathbf{u}' = \mathbf{f}(t,\mathbf{u}) + G(t,\mathbf{u}) \mathbf{u}$, where…

Numerical Analysis · Mathematics 2025-04-15 Lingyun Ding

Problems that feature significantly different time scales, where the stiff time-step restriction comes from a linear component, implicit-explicit (IMEX) methods alleviate this restriction if the concern is linear stability. However, where…

Numerical Analysis · Mathematics 2019-04-16 Leah Isherwood , Zachary J. Grant , Sigal Gottlieb

We apply the concept of effective order to strong stability preserving (SSP) explicit Runge-Kutta methods. Relative to classical Runge-Kutta methods, methods with an effective order of accuracy are designed to satisfy a relaxed set of order…

Numerical Analysis · Mathematics 2014-01-09 Yiannis Hadjimichael , Colin B. Macdonald , David I. Ketcheson , James H. Verner

We present a dynamically load-balanced parallel $ p $-adaptive implicit high-order flux reconstruction method for under-resolved turbulence simulation. The high-order explicit first stage, singly diagonal implicit Runge-Kutta (ESDIRK)…

Computational Physics · Physics 2020-07-15 Lai Wang , Matthias K. Gobbert , Meilin Yu

Sampling with Markov chain Monte Carlo methods often amounts to discretizing some continuous-time dynamics with numerical integration. In this paper, we establish the convergence rate of sampling algorithms obtained by discretizing smooth…

Machine Learning · Statistics 2020-02-04 Xuechen Li , Denny Wu , Lester Mackey , Murat A. Erdogdu

The behavior of some stochastic chemical reaction networks is largely unaffected by slight inaccuracies in reaction rates. We formalize the robustness of state probabilities to reaction rate deviations, and describe a formal connection…

Computational Complexity · Computer Science 2009-01-28 David Soloveichik

Fully implicit Runge-Kutta (IRK) methods have many desirable properties as time integration schemes in terms of accuracy and stability, but high-order IRK methods are not commonly used in practice with numerical PDEs due to the difficulty…

Numerical Analysis · Mathematics 2021-10-07 Ben S. Southworth , Oliver Krzysik , Will Pazner , Hans De Sterck

The class of stochastic Runge-Kutta methods for stochastic differential equations due to R\"o{\ss}ler is considered. Coefficient families of diagonally drift-implicit stochastic Runge-Kutta (DDISRK) methods of weak order one and two are…

Numerical Analysis · Mathematics 2016-05-10 Kristian Debrabant , Andreas Rößler

Many time-dependent differential equations are equipped with invariants. Preserving such invariants under discretization can be important, e.g., to improve the qualitative and quantitative properties of numerical solutions. Recently,…

Numerical Analysis · Mathematics 2023-11-27 Sebastian Bleecke , Hendrik Ranocha

A version of the time-parallel algorithm parareal is analyzed and applied to stochastic models in chemical kinetics. A fast predictor at the macroscopic scale (evaluated in serial) is available in the form of the usual reaction rate…

Numerical Analysis · Mathematics 2009-09-16 Stefan Engblom

This study considers using Metropolis-Hastings algorithm for stochastic simulation of chemical reactions. The proposed method uses SSA (Stochastic Simulation Algorithm) distribution which is a standard method for solving well-stirred…

Numerical Analysis · Computer Science 2014-10-31 Azam S. Zavar Moosavi , Paul Tranquilli , Adrian Sandu