Lattice Microbes 2.3 – Simulation method for the Reaction-diffusion Master Equation

Lattice Microbes 2.3

:: DESCRIPTION

Lattice Microbes is a software package for efficiently sampling trajectories from the chemical and reaction-diffusion master equations (CME/RDME) on high performance computing (HPC) infrastructure using both exact and approximate methods.

::DEVELOPER

The Luthey-Schulten Group – University of Illinois at Urbana-Champaign

:: SCREENSHOTS

N/A

:: REQUIREMENTS

  • Windows/Linux/MacOsX
  • VMD

:: DOWNLOAD

  Lattice Microbes

:: MORE INFORMATION

Citation

Elijah Roberts, John E Stone, and Zaida Luthey-Schulten.
Lattice Microbes: high-performance stochastic simulation method for the reaction-diffusion master equation,
J.Comp.Chem, 34(3):245-255, 2013.

Meredys 20100209 – Multi-compartment Reaction-diffusion Simulator

Meredys 20100209

:: DESCRIPTION

Meredys (MEsoscopic REaction DYnamics Simulator) is a particle based stochastic simulation software designed to model and simulate reaction-diffusion systems.The input to the software is a model of a reaction diffusion system encoded in a Meredys-specic implementation of the NeuroML model description language.

Meredys allows for the simulation of multi-component, multi-feature state molecular species in two and three dimensions. Several compartments can be defined with different diffusion and boundary properties. The software employs a Brownian dynamics engine to simulate reaction-diffusion systems at the reactive particle level, based on compartment properties, complex structure, and hydro-dynamic radii. Zeroth-, first-, and second order reactions are supported. The molecular complexes have realistic geometries. Reactive species can contain user-defined feature states which can modify reaction rates and outcome. Models are defined in a versatile NeuroML input file. The simulation volume can be split in subvolumes to speed up run-time.

::DEVELOPER

Dominic Tolle from the group Computational Neurobiology of theEMBL-EBI

:: SCREENSHOTS

:: REQUIREMENTS

:: DOWNLOAD

Meredys

:: MORE INFORMATION

Meredys is distributed under the General Public Licence.

Citation:

Meredys, a multi-compartment reaction-diffusion simulator using multistate realistic molecular complexesDominic
P Tolle  and Nicolas Le Novère
BMC Systems Biology 2010, 4:24doi:10.1186/1752-0509-4-24

Ilya – Reaction-Diffusion Simulator

Ilya

:: DESCRIPTION

Ilya is a small program for Windows which simulates a reaction-diffusion model based on the Brusselator reaction scheme. Ilya simulates a 2-dimensional rectangular plane with opposite edges connected so that the plane actually forms a torus. The plane is divided up into many small area elements (one area element per screen pixel). The simulation involves computing the rates of change of two chemical species labeled X and Y as a result of both chemical transformations (Brusselator scheme) and diffusion of X and Y to and from adjacent area elements.

::DEVELOPER

PRIDE Converter Team

:: SCREENSHOTS

:: REQUIREMENTS

  • Windows

:: DOWNLOAD

Ilya

:: MORE INFORMATION

Ilya is freely available for educational, private study and research purposes.