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FROM ubuntu:16.04
# General environment for docker
ENV DEBIAN_FRONTEND=noninteractive \
SPACK_ROOT=/usr/local \
FORCE_UNSAFE_CONFIGURE=1
# Install system packages
RUN apt-get update \
&& apt-get install -y --no-install-recommends \
autoconf \
build-essential \
ca-certificates \
coreutils \
curl man less \
emacs-nox vim nano \
git \
openmpi-bin openmpi-common libopenmpi-dev \
python \
unzip \
&& rm -rf /var/lib/apt/lists/*
# Load spack environment on login
COPY spack.sh /etc/profile
# Install spack
RUN curl -s -L https://api.github.com/repos/spack/spack/tarball/develop \
| tar xzC $SPACK_ROOT --strip 1
# Copy configuration for external packages
COPY packages.yaml $SPACK_ROOT/etc/spack/
# Build lmod
RUN spack install lmod && spack clean -a
# Build a compiler
RUN spack install gcc@7.2.0 && spack clean -a
RUN /bin/bash -l -c ' \
spack load gcc@7.2.0 \
&& spack compiler add'
# Build the software on top of the compiler
RUN spack install netlib-scalapack ^openmpi ^openblas %gcc@7.2.0 \
&& spack install netlib-scalapack ^mpich ^openblas %gcc@7.2.0 \
&& spack install netlib-scalapack ^openmpi ^netlib-lapack %gcc@7.2.0 \
&& spack install netlib-scalapack ^mpich ^netlib-lapack %gcc@7.2.0 \
&& spack install py-scipy ^openblas \
&& spack clean -a
# image run hook: the -l will make sure /etc/profile environments are loaded
CMD /bin/bash -l
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