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Repository mmpbsa_mmgbsa
Owner: chemteam
Synopsis: Wrapper for the AmberTools package: MMPBSA/MMGBSA
AmberTools (http://ambermd.org/AmberTools.php) is a set of packages than can be to create forcefields (antechamber), prepare molecules(tleap) and much more.
Type: unrestricted
Revision: 10:608098b3668d
This revision can be installed: True
Times cloned / installed: 347

Contents of this repository

Name Description Version Minimum Galaxy Version
tool for estimating ligand binding affinities 21.10+galaxy0 16.01

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