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ubuntu: only install used boost package #237

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Merged
junghans merged 1 commit into from
Mar 19, 2026
Merged

ubuntu: only install used boost package #237

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5 changes: 3 additions & 2 deletions ubuntu
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Original file line number Diff line number Diff line change
Expand Up @@ -9,8 +9,9 @@
RUN apt-get update && \
apt-get upgrade -y && \
apt-get install -y \
make cmake valgrind git g++ libexpat-dev libfftw3-dev libboost-all-dev txt2tags ccache gnuplot python3-numpy doxygen vim clang llvm python3-pip python3-lxml \
wget libhdf5-dev graphviz pkg-config psmisc libeigen3-dev libxc-dev sudo curl clang-tidy ninja-build libclang-dev llvm-dev libomp-dev libstdc++-13-dev \
make cmake valgrind git g++ libexpat-dev libfftw3-dev libboost-program-options-dev libboost-filesystem-dev libboost-regex-dev libboost-timer-dev libboost-test-dev \
ccache python3-numpy doxygen vim clang llvm python3-pip python3-lxml \
wget libhdf5-dev graphviz pkg-config libeigen3-dev libxc-dev sudo curl clang-tidy ninja-build libclang-dev llvm-dev libomp-dev \
clang-format software-properties-common zstd libint2-dev libecpint-dev python3-rdkit python3-h5py python3-pytest pybind11-dev python3-xmltodict ase && \
apt-get purge --autoremove -y && \
apt-get clean
Expand Down Expand Up @@ -41,8 +42,8 @@
RUN echo '%sudo ALL=(ALL) NOPASSWD:ALL' >> /etc/sudoers
USER votca
ENV PATH=${INTEL:+/opt/intel/oneapi/compiler/latest/bin}${PATH:+:}${PATH}
ENV LD_LIBRARY_PATH=${INTEL:+/opt/intel/oneapi/compiler/latest/lib:/opt/intel/oneapi/mkl/latest/lib}${LD_LIBRARY_PATH:+:}${LD_LIBRARY_PATH}

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Variables should be defined before their use 

UndefinedVar: Usage of undefined variable '$LD_LIBRARY_PATH'
More info: https://docs.docker.com/go/dockerfile/rule/undefined-var/

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Variables should be defined before their use 

UndefinedVar: Usage of undefined variable '$LD_LIBRARY_PATH'
More info: https://docs.docker.com/go/dockerfile/rule/undefined-var/

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Variables should be defined before their use 

UndefinedVar: Usage of undefined variable '$LD_LIBRARY_PATH'
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UndefinedVar: Usage of undefined variable '$LD_LIBRARY_PATH'
More info: https://docs.docker.com/go/dockerfile/rule/undefined-var/
ENV CMAKE_PREFIX_PATH=${INTEL:+/opt/intel/oneapi/mkl/latest/lib/cmake:}${CMAKE_PREFIX_PATH}

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Variables should be defined before their use 

UndefinedVar: Usage of undefined variable '$CMAKE_PREFIX_PATH'
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Variables should be defined before their use 

UndefinedVar: Usage of undefined variable '$CMAKE_PREFIX_PATH'
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Variables should be defined before their use 

UndefinedVar: Usage of undefined variable '$CMAKE_PREFIX_PATH'
More info: https://docs.docker.com/go/dockerfile/rule/undefined-var/

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UndefinedVar: Usage of undefined variable '$CMAKE_PREFIX_PATH'
More info: https://docs.docker.com/go/dockerfile/rule/undefined-var/
ENV CCACHE_MAXSIZE=250M
WORKDIR /home/votca

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