HANA

Requirements

1. Dowloand Anaconda navigator. https://www.anaconda.com/download

2. Create a virtual ambient with conda and rdkit.

    conda create -c conda-forge -n my-rdkit-env rdkit
   

3. Install Jupyter notebook. Open anaconda navigator with:

    anaconda-navigator
   

   In Anaconda navigator change <base(root)> to . Then, install Jupyter notebook. Close Anaconda navigator and return to terminal.

4. Activate virtual ambient.

    conda activate my-rdkit-env
   

5. Install git module

    pip install gitpython
   

6. Clone repository

   git clone https://github.com/DIFACQUIM/HANA.git
   

7. See examples_files.py