Dockerfile

# This container is a basic web frontend, we do the heavy-lifting in the
# main DiffDock-Pocket image.
FROM silterra/diffdock-pocket

USER $APPUSER
WORKDIR $HOME/app

COPY --chown=$APPUSER:$APPUSER . $HOME/app

RUN ~/bin/micromamba install -n $ENV_NAME -c conda-forge -c defaults --file requirements.txt

# Expose port for web service
EXPOSE 7860

# Run app under micromamba environment
CMD ["sh", "-c", "micromamba run -n ${ENV_NAME} python3 main.py"]
# CMD ["python3", "main.py"]