Installation
------------
IntegrAO works with Python >= 3.7. Please make sure you have the correct version of Python pre-installation.

1. Create a virtual environment:  `conda create -n integrAO python=3.10 -y` and `conda activate integrAO`
2. Install [Pytorch 2.1.0](https://pytorch.org/get-started/locally/)
3. IntegrAO is available on PyPI. To install IntegrAO, run the following command: `pip install integrao`

For developing, clone this repo with following commands::

   git clone this-repo-url
   cd IntegrAO
   pip install -r requirement.txt