rdkit2fps
cheminformatics fingerprints file formats and tools
RUN apt-get update && \
apt-get install -y python-chemfp
RUN apt-get update && \
apt-get install -y python-chemfp
RUN apt-get update && \
apt-get install -y python-chemfp
RUN apt-get update && \
apt-get install -y python-chemfp