Installation

Clone the repository:

$ git clone https://github.com/pnnl/deimos.git

Use conda to create a virtual environment with required dependencies. First, ensure conda and anaconda are updated:

$ conda update conda
$ conda update anaconda

Create the virtual environment:

$ cd deimos/
$ conda env create -f environment.yml

Activate the virtual environment:

$ conda activate deimos

Install DEIMoS using pip:

$ pip install -e .