py_install.rst

Python installation

You can install gau2grid with conda or by installing from source.

Conda

You can update gau2grid using conda:

conda install pygau2grid -c psi4

This installs gau2grid and the NumPy dependancy.

Install from Source

To install gau2grid from source, clone the repository from github:

git clone https://github.com/dgasmith/gau2grid.git
cd gau2grid
python setup.py install

Test

Test gau2grid with py.test:

cd gau2grid
py.test