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Machine learning for molecular dynamics.

Project description

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<img width="300" src="https://github.com/yngtodd/molecules/blob/master/img/molecules.png">
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.. image:: https://badge.fury.io/py/molecules.png
:target: http://badge.fury.io/py/molecules

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Molecules
=========

Machine learning for molecular dynamics.

Documentation
--------------

For references, tutorials, and examples check out our `documentation`_.

Installation
------------

From Sources:

You can either clone the public repository:

.. code-block:: console

git clone git://github.com/yngtodd/molecules

Or download the `tarball`_:

.. code-block:: console

curl -OL https://github.com/yngtodd/molecules/tarball/master

Once you have a copy of the source, you can install it with:

.. code-block:: console

python setup.py install


.. _tarball: https://github.com/yngtodd/molecules/tarball/master
.. _documentation: https://molecules.readthedocs.io/en/latest



Documentation
-------------

The full documentation is at http://molecules.rtfd.org.



History
-------

0.0.1 (2018-10-3)
++++++++++++++++++

* First release on PyPI.

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