Metadata-Version: 1.1
Name: qc-iodata
Version: 1.0.0a1.post80
Summary: Python Input and Output Library for Quantum Chemistry.
Home-page: https://github.com/theochem/iodata
Author: HORTON-ChemTools Dev Team
Author-email: horton.chemtools@gmail.com
License: UNKNOWN
Description: ..
            : IODATA is an input and output module for quantum chemistry.
            :
            : Copyright (C) 2011-2019 The IODATA Development Team
            :
            : This file is part of IODATA.
            :
            : IODATA is free software; you can redistribute it and/or
            : modify it under the terms of the GNU General Public License
            : as published by the Free Software Foundation; either version 3
            : of the License, or (at your option) any later version.
            :
            : IODATA is distributed in the hope that it will be useful,
            : but WITHOUT ANY WARRANTY; without even the implied warranty of
            : MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
            : GNU General Public License for more details.
            :
            : You should have received a copy of the GNU General Public License
            : along with this program; if not, see <http://www.gnu.org/licenses/>
            :
            : --
        
        IOData
        ======
        |Travis|
        |Conda|
        |Pypi|
        |Codecov|
        |Version|
        |CondaVersion|
        |License|
        
        
        About
        -----
        IOData is a HORTON 3 module for input/output of quantum chemistry file formats. Documentation is
        here: https://iodata.readthedocs.io/en/latest/index.html
        
        
        Dependencies
        ------------
        
        The following dependencies will be necessary for IOData to build properly,
        
        * Python >= 3.6: http://www.python.org/
        * SciPy >= 0.11.0: http://www.scipy.org/
        * NumPy >= 1.9.1: http://www.numpy.org/
        * pytest >= 4.2.0: https://docs.pytest.org/
        
        
        Installation
        ------------
        
        To install IOData using conda package management system, install
        `miniconda <https://conda.io/miniconda.html>`__ or
        `anaconda <https://www.anaconda.com/download>`__ first, and then:
        
        .. code-block:: bash
        
            $ conda create -n iodata_env
            $ source activate iodata_env
            (iodata_env) $ conda install -c theochem iodata
        
        See https://iodata.readthedocs.io/en/latest/install.html for full details.
        
        .. |Travis| image:: https://travis-ci.org/theochem/iodata.svg?branch=master
            :target: https://travis-ci.org/theochem/iodata
        .. |Version| image:: https://img.shields.io/pypi/pyversions/iodata.svg
        .. |License| image:: https://img.shields.io/github/license/theochem/iodata
        .. |Pypi| image:: https://img.shields.io/pypi/v/iodata.svg
            :target: https://pypi.python.org/pypi/iodata/0.1.3
        .. |Codecov| image:: https://img.shields.io/codecov/c/github/theochem/iodata/master.svg
            :target: https://codecov.io/gh/theochem/iodata
        .. |Conda| image:: https://img.shields.io/conda/v/theochem/iodata.svg
            :target: https://anaconda.org/theochem/iodata
        .. |CondaVersion| image:: https://img.shields.io/conda/pn/theochem/iodata.svg
            :target: https://anaconda.org/theochem/iodata
        
Platform: UNKNOWN
Classifier: Development Status :: 3 - Alpha
Classifier: Environment :: Console
Classifier: License :: OSI Approved :: GNU General Public License v3 or later (GPLv3+)
Classifier: Operating System :: POSIX :: Linux
Classifier: Programming Language :: Python :: 3
Classifier: Topic :: Scientific/Engineering :: Physics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Intended Audience :: Science/Research
