Category

Molecular Dynamics

Category

Molecular Dynamics of Mixtures (MDynaMix) is a computer software package for general purpose molecular dynamics to simulate mixtures of molecules,…

MacroModel is a computer program for molecular modeling of organic compounds and biopolymers. Its features include force fields coupled with energy minimization algorithms…

GROMOS stands for GROningen MOlecular Simulation computer program package, which has been developed since 1978 for the dynamic modelling of…

GROMACS is a versatile package to perform molecular dynamics, such as simulating the Newtonian equations of motion for systems with hundreds…

CHARMM is the full form of Chemistry at HARvard Macromolecular Mechanics that is the molecular simulation program with wide application to…