Installation

cholla_chem supports Python versions >=3.10. Java 8+ is required to run OPSIN.

Installation Option #1: Use pip (recommended)

Install cholla_chem with pip directly from the github repo:

pip install git+https://github.com/denovochem/cholla_chem.git

Installation Option #2: Clone the repository

Install the latest version of cholla_chem from GitHub. The version on GitHub is not guaranteed to be stable, but may include new features not available using other install options. Clone the repository and install:

git clone https://github.com/denovochem/cholla_chem.git
cd cholla_chem
pip install .