.. image:: https://github.com/ryjmacdonell/gimbal/blob/master/docs/gimbal_logo.svg

.. image:: https://travis-ci.org/ryjmacdonell/gimbal.svg?branch=master    :target: https://travis-ci.org/ryjmacdonell/gimbal

.. image:: https://readthedocs.org/projects/gimbal-editor/badge/?version=latest :target: https://gimbal-editor.readthedocs.io/en/latest/?badge=latest

.. image:: https://codecov.io/gh/ryjmacdonell/gimbal/branch/master/graph/badge.svg    :target: https://codecov.io/gh/ryjmacdonell/gimbal

.. image:: https://badge.fury.io/py/gimbal.svg :target: https://badge.fury.io/py/gimbal

Gimbal is a package for importing, creating, editing and querying three-dimensional molecular geometries. It specializes in intramolecular transformations relevant to dynamical simulation.

Installation

To install the latest release from PyPI, use::

$ pip install gimbal

Alternatively, clone the repository and use setup.py to install via::

$ git clone https://github.com/ryjmacdonell/gimbal.git
$ cd gimbal/
$ python setup.py install

Installation will also add several executables from bin/ to your path for easily editing recognized file formats.

Requirements

Requires at least Python 3.4, NumPy v1.6.0, SciPy v0.9.0 and PyParsing v2.2.0

Documentation

For additional documentation, see the documentation page <https://gimbal-editor.readthedocs.io/en/latest>_.

Author

Ryan J. MacDonell