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Repository mdanalysis_hbonds
Name: mdanalysis_hbonds
Owner: chemteam
Synopsis: Wrapper for the MDAnalysis package: Hydrogen Bond Analysis
MDAnalysis (https://www.mdanalysis.org) is a Python toolkit to analyze molecular dynamics trajectories generated by a wide range of popular simulation packages including DL_Poly, CHARMM, Amber, NAMD, LAMMPS, and Gromacs. 
Content homepage: https://github.com/MDAnalysis/mdanalysis
Development repository: https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/
Link to this repository revision: https://toolshed.g2.bx.psu.edu/view/chemteam/mdanalysis_hbonds/5efd0c95f97e
Clone this repository: hg clone https://toolshed.g2.bx.psu.edu/repos/chemteam/mdanalysis_hbonds
Type: unrestricted
Revision: 3:5efd0c95f97e
This revision can be installed: True
Times cloned / installed: 328

Contents of this repository

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Name Description Version Minimum Galaxy Version
- analyze H-bonds between two segments 0.20 16.01

Categories
Computational chemistry - Tools for use in computational chemistry