cda-3.6
Parsers and algorithms for computational chemistry (Python3 module)
RUN apt-get update && \
apt-get install -y python3-cclib
RUN apt-get update && \
apt-get install -y python3-cclib
RUN apt-get update && \
apt-get install -y python3-cclib
RUN dnf install -y python3-cclib
RUN apt-get update && \
apt-get install -y python3-cclib