rdkit

downloads

Open-Source Cheminformatics Software

Home http://rdkit.org
Versions 2015.09.2, 2016.03.3
License BSD
Recipe https://github.com/bioconda/bioconda-recipes/tree/master/recipes/rdkit/2016.03.3

Installation

With an activated Bioconda channel (see 2. Set up channels), install with:

conda install rdkit

and update with:

conda update rdkit

docker

A Docker container is available at https://quay.io/repository/biocontainers/rdkit.