zero323/docker-rdkit repository overview

docker pull zero323/rdkit:jupyter

# Create data container.
# See: http://www.tech-d.net/2013/12/16/persistent-volumes-with-docker-container-as-volume-pattern/
docker run --name rdkit_notebooks -v /data/notebooks busybox sh

# Run container and expose port 8888 on the localhost
docker run -p 8888:8888 -d --volumes-from rdkit_notebooks zero323/rdkit:jupyter