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Repository mmpbsa_mmgbsa
Name: 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.
Content homepage: http://ambermd.org/AmberTools.php
Development repository: https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/
Link to this repository revision: https://toolshed.g2.bx.psu.edu/view/chemteam/mmpbsa_mmgbsa/879662481176
Clone this repository: hg clone https://toolshed.g2.bx.psu.edu/repos/chemteam/mmpbsa_mmgbsa
Type: unrestricted
Revision: 4:879662481176
This revision can be installed: True
Times cloned / installed: 1282

Contents of this repository

Valid tools - click the name to preview the tool and use the pop-up menu to inspect all metadata
Name Description Version Minimum Galaxy Version
tool for estimating ligand binding affinities 20.15+galaxy0 16.01

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