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| 1 | +FROM ghcr.io/e3sm-project/containers-inputdata-files-standalone:main |
| 2 | + |
| 3 | +ARG GCC_VERSION=11.4.0 |
| 4 | +ARG MPICH_VERSION=4.2.1 |
| 5 | +ARG SZIP_VERSION=2.1.1 |
| 6 | +ARG HDF5_VERSION=1.12.3 |
| 7 | +ARG NETCDFC_VERSION=4.9.2 |
| 8 | +ARG NETCDFCXX_VERSION=4.2 |
| 9 | +ARG NETCDFFORTRAN_VERSION=4.6.1 |
| 10 | +ARG PNETCDF_VERSION=1.12.1 |
| 11 | + |
| 12 | +ENV GCC_VERSION=${GCC_VERSION} |
| 13 | +ENV MPICH_VERSION=${MPICH_VERSION} |
| 14 | +ENV SZIP_VERSION=${SZIP_VERSION} |
| 15 | +ENV HDF5_VERSION=${HDF5_VERSION} |
| 16 | +ENV NETCDFC_VERSION=${NETCDFC_VERSION} |
| 17 | +ENV NETCDFCXX_VERSION=${NETCDFCXX_VERSION} |
| 18 | +ENV NETCDFFORTRAN_VERSION=${NETCDFFORTRAN_VERSION} |
| 19 | +ENV PNETCDF_VERSION=${PNETCDF_VERSION} |
| 20 | + |
| 21 | +RUN apt-get update |
| 22 | +RUN apt-get -y upgrade |
| 23 | +RUN apt-get -y remove cmake |
| 24 | +RUN apt-get -y install software-properties-common |
| 25 | +RUN add-apt-repository universe |
| 26 | +RUN apt-get update && apt-get -y install \ |
| 27 | + locales csh m4 libcurl4-openssl-dev \ |
| 28 | + libz-dev gcc g++ gfortran liblapack-dev make git \ |
| 29 | + git wget subversion libxml2-dev libxml2-utils libxml-libxml-perl \ |
| 30 | + libswitch-perl build-essential checkinstall zlib1g-dev libssl-dev \ |
| 31 | + python3-distutils python-is-python3 python3-pip python3-full |
| 32 | + |
| 33 | +RUN python -m pip install netcdf4 pyyaml psutil pylint nanobind |
| 34 | + |
| 35 | +RUN python -m pip cache purge |
| 36 | +RUN apt-get -y autoremove |
| 37 | + |
| 38 | +# TODO: move to env file (spack.yaml)? |
| 39 | +RUN mkdir -p /opt/spack-environment \ |
| 40 | +&& (echo "spack:" \ |
| 41 | +&& echo " " \ |
| 42 | +&& echo " definitions:" \ |
| 43 | +&& echo " - compilers: [gcc@${GCC_VERSION}]" \ |
| 44 | +&& echo " - mpis: [mpich@${MPICH_VERSION}]" \ |
| 45 | +&& echo " - mpipkgs:" \ |
| 46 | +&& echo " - hdf5@${HDF5_VERSION}" \ |
| 47 | +&& echo " - netcdf-c@${NETCDFC_VERSION}" \ |
| 48 | +&& echo " - netcdf-cxx@${NETCDFCXX_VERSION}" \ |
| 49 | +&& echo " - netcdf-fortran@${NETCDFFORTRAN_VERSION}" \ |
| 50 | +&& echo " - parallel-netcdf@${PNETCDF_VERSION}" \ |
| 51 | +&& echo " - othpkgs:" \ |
| 52 | +&& echo " - cmake" \ |
| 53 | +&& echo " - cprnc" \ |
| 54 | +&& echo " - yaml-cpp" \ |
| 55 | +&& echo " - fmt" \ |
| 56 | +&& echo " - spdlog" \ |
| 57 | +&& echo " " \ |
| 58 | +&& echo " specs:" \ |
| 59 | +&& echo " - szip" \ |
| 60 | +&& echo " - matrix:" \ |
| 61 | +&& echo " - [\$mpis]" \ |
| 62 | +&& echo " - [\$%compilers]" \ |
| 63 | +&& echo " - matrix:" \ |
| 64 | +&& echo " - [\$othpkgs]" \ |
| 65 | +&& echo " - [\$%compilers]" \ |
| 66 | +&& echo " - matrix:" \ |
| 67 | +&& echo " - [\$mpipkgs]" \ |
| 68 | +&& echo " - [\$^mpis]" \ |
| 69 | +&& echo " - [\$%compilers]" \ |
| 70 | +&& echo " " \ |
| 71 | +&& echo " concretizer:" \ |
| 72 | +&& echo " unify: true" \ |
| 73 | +&& echo " " \ |
| 74 | +&& echo " config:" \ |
| 75 | +&& echo " install_tree: /opt/software" \ |
| 76 | +&& echo " " \ |
| 77 | +&& echo " view: /usr/local/packages" \ |
| 78 | +&& echo "") > /opt/spack-environment/spack.yaml |
| 79 | + |
| 80 | +# TODO: do these intervene with each other? |
| 81 | +# https://cache.spack.io/tag/v0.22.2/ |
| 82 | +RUN spack mirror add v0.22.2 https://binaries.spack.io/v0.22.2 |
| 83 | +RUN spack buildcache keys --install --trust |
| 84 | +# https://cache.spack.io/tag/v0.22.1/?stack=e4s |
| 85 | +RUN spack mirror add v0.22.2-e4s https://binaries.spack.io/v0.22.2/e4s |
| 86 | +RUN spack buildcache keys --install --trust |
| 87 | +# https://cache.spack.io/tag/v0.22.2/?stack=root# |
| 88 | +RUN spack mirror add v0.22.2-root https://binaries.spack.io/v0.22.2/root |
| 89 | +RUN spack buildcache keys --install --trust |
| 90 | + |
| 91 | +# TODO: add e4s inventory when they support ubuntu 22.04+ |
| 92 | +# # https://oaciss.uoregon.edu/e4s/inventory.html |
| 93 | +# RUN spack mirror add E4S-24.0 https://cache.e4s.io/24.0 |
| 94 | +# RUN spack buildcache keys -it |
| 95 | +# RUN spack mirror add E4S https://cache.e4s.io |
| 96 | +# RUN spack buildcache keys -it |
| 97 | + |
| 98 | +RUN cd /opt/spack-environment && spack env activate . && spack install --fail-fast && spack gc -y |
| 99 | + |
| 100 | +RUN cd /opt/spack-environment && \ |
| 101 | + spack env activate --sh -d . >> /etc/profile.d/z10_spack_environment.sh |
| 102 | + |
| 103 | +ENV USER=ghciocitester |
| 104 | + |
| 105 | +RUN git config --global user.email "${USER}@${USER}.${USER}" |
| 106 | +RUN git config --global user.name "${USER}" |
| 107 | + |
| 108 | +ARG DEBIAN_FRONTEND=noninteractive |
| 109 | +ENV TZ=America/Los_Angeles |
| 110 | + |
| 111 | +ENV LANGUAGE=en_US:en \ |
| 112 | + LANG=en_US.UTF-8 |
| 113 | + |
| 114 | +# TODO: maybe add a test here or in the workflow? |
| 115 | + |
| 116 | +ENTRYPOINT ["/bin/bash", "--rcfile", "/etc/profile", "-l"] |
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