Cloud_dockerfile

FROM python:3.9 AS calcus_user

ARG CALCUS_VERSION_HASH
ENV CALCUS_VERSION_HASH=${CALCUS_VERSION_HASH}

ENV PYTHONUNBUFFERED 1
ENV CALCUS_CLOUD True

ADD ./cloud_requirements.txt /calcus/cloud_requirements.txt
RUN pip install -r /calcus/cloud_requirements.txt
RUN apt update && apt install openbabel postgresql-client dos2unix -y

COPY calcus /calcus/calcus
COPY frontend /calcus/frontend
COPY docker /calcus/docker
COPY scripts /calcus/scripts
COPY bin /binaries/xtb
COPY manage.py /calcus/manage.py

WORKDIR /calcus/

ENV XTB4STDAHOME "/binaries/xtb"
ENV XTBPATH "/binaries/xtb/xtb:$XTB4STDAHOME"
ENV STDAHOME "/binaries/xtb"
ENV PATH=$PATH:$XTB4STDAHOME/xtb/bin:$XTB4STDAHOME

RUN python scripts/extract_xtb.py

RUN adduser --disabled-password --gecos '' calcus  

CMD exec gunicorn calcus.wsgi:application --bind :$PORT --timeout 10 --workers $NUM_WORKERS --threads $NUM_THREADS --timeout $GUNICORN_TIMEOUT