MDynaMix

Molecular Dynamics of Mixtures (MDynaMix) is a computer software package for general purpose molecular dynamics to simulate mixtures of molecules, interacting by AMBER- and CHARMM-like force fields in periodic boundary conditions.^[2][3] Algorithms are included for NVE, NVT, NPT, anisotropic NPT ensembles, and Ewald summation to treat electrostatic interactions. The code was written in a mix of Fortran 77 and 90 (with Message Passing Interface (MPI) for parallel execution). The package runs on Unix and Unix-like (Linux) workstations, clusters of workstations, and on Windows in sequential mode.

Original authorsAatto Laaksonen, Alexander Lyubartsev

DevelopersStockholm University, Department of Materials and Environmental Chemistry, Division of Physical Chemistry

Initial release1993; 33 years ago (1993)

Stable release

5.3.0 / 15 January 2019; 7 years ago (2019-01-15)^[1]

Quick facts Molecular Dynamics of Mixtures, Original authors ...

Molecular Dynamics of Mixtures
DNA simulation on MDynaMix
Original authors	Aatto Laaksonen, Alexander Lyubartsev
Developers	Stockholm University, Department of Materials and Environmental Chemistry, Division of Physical Chemistry
Initial release	1993; 33 years ago (1993)
Stable release	5.3.0 / 15 January 2019; 7 years ago (2019-01-15)[1]
Written in	Fortran 77-90
Operating system	Unix, Unix-like, Linux, Windows
Platform	x86, x86-64, Cray
Available in	English
Type	Molecular dynamics
License	GPL
Website	www.fos.su.se/~sasha/mdynamix

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MDynaMix is developed at the Division of Physical Chemistry, Department of Materials and Environmental Chemistry, Stockholm University, Sweden. It is released as open-source software under a GNU General Public License (GPL).