=========================== Installation and Quickstart =========================== chemlab is currently tested on Ubuntu 12.10 and python 2.7. First install the dependencies:: $ sudo apt-get install python-numpy python-scipy python-matplotlib python-pyside python-opengl cython `Download `_ unpack and install chemalb from the setup.py included in the package:: $ wget https://pypi.python.org/packages/source/c/chemlab/chemlab-0.1.tar.gz $ tar xvzf chemlab-0.1.tar.gz $ cd chemlab-0.1 $ sudo python setup.py install Test the newly installed package by typing:: $ chemlab view tests/data/cry.gro The molecular viewer should display a crystal, if not, file an issue on `github `_. .. image:: _static/licl.png :width: 600px Once you're setup you're ready to to dig in chemlab's features contained in the :ref:`user-manual`. Developement ------------ After installing the dependencies, grab the chemlab source from git:: $ git clone --recursive https://github.com/chemlab/chemlab.git Complile the included extensions:: $ python setup.py build_ext --inplace Just add the chemlab directory to the PYTHONPATH in your .bashrc:: export PYTHONPATH=$PYTHONPATH:/path/to/chemlab