Metadata-Version: 1.1
Name: pyOBabel
Version: 0.1.1
Summary: A python binding to openbabel chemical toolbox (http://openbabel.org)
Home-page: https://github.com/rjdkmr/pyOBabel
Author: Rajendra Kumar
Author-email: rjdkmr@gmail.com
License: GNU General Public License v3 (GPLv3)
Description: .. image:: https://travis-ci.org/rjdkmr/pyOBabel.svg?branch=master
            :target: https://travis-ci.org/rjdkmr/pyOBabel
        
        pyOBabel
        ========
        
        It is a Python interface for `openbabel chemical toolbox <http://openbabel.org>`_.
        
        It is not the official Python interface of openbabel and may lack many functionality of openbabel.
        If you are looking for official Python, Please follow this
        `link <http://openbabel.org/docs/dev/UseTheLibrary/Python_PybelAPI.html>`_.
        
        
        Why another Python interface
        ----------------------------
        The official Python interface to openbabel was built using `SWIG <http://www.swig.org/>`_.
        However, I used `pybind11 <http://pybind11.readthedocs.io>`_ to built the Python interface.
        It gives flexibility in building Python interface such that the obtained Python interface
        can be used in pythonic way.
        
        
        Please cite the original publication of the openbabel:
        ------------------------------------------------------
        # O'Boyle et al (2011)
        # Open Babel: An open chemical toolbox
        # Journal of Cheminformatics 2011 3:33
        # https://doi.org/10.1186/1758-2946-3-33 .
        
Keywords: Molecular Modeling,Chemoinformatics,Computational Chemistry,Computational Drug Design
Platform: UNKNOWN
Classifier: Environment :: Console
Classifier: Intended Audience :: Developers
Classifier: Intended Audience :: End Users/Desktop
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: GNU General Public License v3 (GPLv3)
Classifier: Natural Language :: English
Classifier: Operating System :: MacOS
Classifier: Operating System :: POSIX :: Linux
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
