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Repository openbabel_spectrophore_search
Name: openbabel_spectrophore_search
Owner: bgruening
Synopsis: Spectrophores search tool from Open Babel chemical toolbox
Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.

Home page: https://github.com/openbabel/openbabel
License: GPL Version 2
Content homepage: https://github.com/openbabel/openbabel
Development repository: https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel
Link to this repository revision: https://toolshed.g2.bx.psu.edu/view/bgruening/openbabel_spectrophore_search/330514267c57
Clone this repository: hg clone https://toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_spectrophore_search
Type: unrestricted
Revision: 14:330514267c57
This revision can be installed: True
Times cloned / installed: 526

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
- similarity search based on 1D chemical features 3.1.1+galaxy0 16.01

Categories
Computational chemistry - Tools for use in computational chemistry