Installation#

Installation with mamba#

cinnabar is available through conda-forge and can be installed with mamba (or conda):

$ mamba install -c conda-forge cinnabar

Developer Installation#

If you’re a developer, you will likely want to create a local editable installation.

  1. clone the repository:

$ git clone https://github.com/OpenFreeEnergy/cinnabar.git
$ cd cinnabar

  1. create and activate a new environment:

$ mamba create -f devtools/conda-envs/env.yml
$ mamba activate cinnabar

  1. build an editable installation:

$ python -m pip install --no-deps -e .