Metadata-Version: 1.2
Name: exatomic
Version: 0.5.6
Summary: A unified platform for theoretical and computational chemists.
Home-page: https://github.com/exa-analytics/exatomic
Author: Thomas J. Duignan, Alex Marchenko and contributors
Author-email: exa.data.analytics@gmail.com
Maintainer-email: exa.data.analytics@gmail.com
License: Apache License Version 2.0
Download-URL: https://pypi.io/packages/source/e/exatomic/exatomic-0.5.6.tar.gz
Description: |exatomic logo|
        
        *A unified platform for computational chemists*
        
        |image1| |image2|
        
        Installation
        ============
        
        |conda Badge|
        
        |pypi badge|
        
        Exa is available through
        `anaconda <https://www.continuum.io/downloads>`__
        
        ::
        
           $ conda install -c exaanalytics exatomic
        
        or `pypi <https://pypi.python.org/pypi>`__.
        
        ::
        
           $ pip install exatomic
           $ jupyter nbextension enable --py --sys-prefix exatomic
        
        Getting Started
        ===============
        
        See `docs <https://exa-analytics.github.io/exatomic/>`__ for usage.
        
        Building the docs requires
        `sphinx <http://www.sphinx-doc.org/en/stable>`__. On Linux or Mac:
        
        ::
        
           $ cd docs
           $ make html
        
        On Windows:
        
        ::
        
           $ cd docs
           $ ./make.bat html
        
        Contributing
        ============
        
        |Travis-CI|
        
        |AppVeyor|
        
        |Codacy Badge|
        
        |Coverage Status|
        
        For a development ready installation:
        
        ::
        
           $ git clone https://github.com/exa-analytics/exatomic.git
           $ cd exatomic
           $ pip install -e .
           $ jupyter nbextension install --py --symlink --sys-prefix exatomic
           $ jupyter nbextension enable --py --sys-prefix exatomic
        
        Note that this requires npm. On Windows, symlinks will not work but as a
        work- around, extensions can be recompiled and reinstalled upon edits
        without the need to reinstall the package.
        
        Reference
        =========
        
        |DOI|
        
        Legal
        =====
        
        | |Apache License 2.0|
        | Copyright (c) 2015-2020, Exa Analytics Development Team
        | Distributed under the terms of the Apache License 2.0
        
        .. |exatomic logo| image:: docs/source/static/logo.png
           :target: https://exa-analytics.github.io
        .. |image1| image:: docs/source/static/demo.gif
        .. |image2| image:: docs/source/static/water-demo.gif
        .. |conda Badge| image:: https://anaconda.org/exaanalytics/exatomic/badges/installer/conda.svg
           :target: https://conda.anaconda.org/exaanalytics
        .. |pypi badge| image:: https://badge.fury.io/py/exatomic.svg
           :target: https://badge.fury.io/py/exatomic
        .. |Travis-CI| image:: https://travis-ci.org/exa-analytics/exatomic.svg?branch=master
           :target: https://travis-ci.org/exa-analytics/exatomic
        .. |AppVeyor| image:: https://ci.appveyor.com/api/projects/status/0r60r3n1w52mi4mj?svg=true
           :target: https://ci.appveyor.com/project/avmarchenko/exatomic
        .. |Codacy Badge| image:: https://app.codacy.com/project/badge/Grade/5d09bae30d6746d1be212f881579bae3
           :target: https://www.codacy.com/gh/exa-analytics/exatomic?utm_source=github.com&utm_medium=referral&utm_content=exa-analytics/exatomic&utm_campaign=Badge_Grade
        .. |Coverage Status| image:: https://coveralls.io/repos/github/exa-analytics/exatomic/badge.svg?branch=master
           :target: https://coveralls.io/github/exa-analytics/exatomic?branch=master
        .. |DOI| image:: https://zenodo.org/badge/23807/exa-analytics/exatomic.svg
           :target: https://zenodo.org/badge/latestdoi/23807/exa-analytics/exatomic
        .. |Apache License 2.0| image:: http://img.shields.io/:license-apache-blue.svg?style=flat-square
           :target: http://www.apache.org/licenses/LICENSE-2.0
        
Keywords: quantum chemistry,jupyter notebook,visualization
Platform: UNKNOWN
Classifier: Development Status :: 4 - Beta
Classifier: Environment :: Web Environment
Classifier: Intended Audience :: Developers
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: Apache Software License
Classifier: Programming Language :: Python :: 3
Classifier: Natural Language :: English
