Repository gmx_fep
Name: gmx_fep
Owner: chemteam
Synopsis: Wrapper for the freeenergy package: Alchemical Run
Type: unrestricted
Revision: 2:c1bcdba99bb3
This revision can be installed: True
Times cloned / installed: 161

Contents of this repository

Name Description Version Minimum Galaxy Version
Alchemical free energy simulations using gromacs 2019.1 16.01

Categories
Molecular Dynamics - Tools for studying the physical movements of atoms and molecules
Computational chemistry - Tools for use in computational chemistry