stop using the deprecated fingerprint API #242
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| name: conda-forge build | |
| on: [push] | |
| jobs: | |
| unix-build: | |
| name: unix build (${{ matrix.config.os }} ${{ matrix.build-type }} rdkit:${{ matrix.rdkit }}) | |
| runs-on: ${{ matrix.config.os }} | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| config: | |
| - os: ubuntu-latest | |
| miniforge-url: "https://github.com/conda-forge/miniforge/releases/latest/download/Miniforge3-Linux-x86_64.sh" | |
| c-compiler: gcc_linux-64 | |
| cxx-compiler: gxx_linux-64 | |
| link-path-env-var: LD_LIBRARY_PATH | |
| - os: macos-latest | |
| miniforge-url: "https://github.com/conda-forge/miniforge/releases/latest/download/Miniforge3-MacOSX-x86_64.sh" | |
| c-compiler: clang_osx-64 | |
| cxx-compiler: clangxx_osx-64 | |
| link-path-env-var: DYLD_LIBRARY_PATH | |
| rdkit: | |
| - 2023.09.4 | |
| build-type: | |
| - Release | |
| - Debug | |
| steps: | |
| # Checks-out your repository under $GITHUB_WORKSPACE, so your job can access it | |
| - uses: actions/checkout@v2 | |
| # Setup a miniforge distribution | |
| - uses: conda-incubator/setup-miniconda@v2 | |
| with: | |
| installer-url: ${{ matrix.config.miniforge-url }} | |
| allow-softlinks: true | |
| show-channel-urls: true | |
| use-only-tar-bz2: false | |
| activate-environment: "" | |
| # Display some diagnostic info and configure the available conda installation | |
| - name: Run conda info | |
| shell: bash -l {0} | |
| run: | | |
| conda config --set always_yes yes --set changeps1 no | |
| conda info | |
| # Create an environment for building and testing chemicalite | |
| - name: Create the conda environment | |
| shell: bash -l {0} | |
| run: > | |
| conda create -n chemicalite-build | |
| cmake ${{ matrix.config.c-compiler }} ${{ matrix.config.cxx-compiler }} | |
| sqlite rdkit=${{ matrix.rdkit }} libboost-devel eigen catch2=3 zlib | |
| # Build and test | |
| - name: Build and test the chemicalite extension | |
| shell: bash -l {0} | |
| run: | | |
| conda activate chemicalite-build | |
| cmake -D CMAKE_BUILD_TYPE=${{ matrix.build-type }} . | |
| cmake --build . --config ${{ matrix.build-type }} | |
| ${{ matrix.config.link-path-env-var }}=$PWD/src ctest -C ${{ matrix.build-type }} --output-on-failure | |
| conda deactivate | |
| # Destroy the build environment | |
| - name: Destroy the build environment | |
| shell: bash -l {0} | |
| run: conda remove -n chemicalite-build --all | |
| windows-build: | |
| if: "false" # DISABLED | |
| name: windows build (${{ matrix.config.os }} ${{ matrix.build-type }} rdkit:${{ matrix.rdkit }}) | |
| runs-on: ${{ matrix.config.os }} | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| config: | |
| - os: windows-latest | |
| miniforge-url: "https://github.com/conda-forge/miniforge/releases/latest/download/Miniforge3-Windows-x86_64.exe" | |
| rdkit: | |
| - 2023.09.4 | |
| build-type: | |
| - Release | |
| #- Debug | |
| steps: | |
| # Checks-out your repository under $GITHUB_WORKSPACE, so your job can access it | |
| - uses: actions/checkout@v2 | |
| # Setup a miniforge distribution | |
| - uses: conda-incubator/setup-miniconda@v2 | |
| with: | |
| #installer-url: ${{ matrix.config.miniforge-url }} | |
| channels: conda-forge | |
| channel-priority: strict | |
| allow-softlinks: true | |
| show-channel-urls: true | |
| use-only-tar-bz2: false | |
| activate-environment: "" | |
| # Display some diagnostic info and configure the available conda installation | |
| - name: Run conda info | |
| shell: bash -l {0} | |
| run: | | |
| conda config --set always_yes yes --set changeps1 no | |
| conda info | |
| # Create an environment for building and testing chemicalite | |
| - name: Create the conda environment | |
| shell: bash -l {0} | |
| run: > | |
| conda create -n chemicalite-build | |
| rdkit=${{ matrix.rdkit }} eigen | |
| # Build and test | |
| - name: Build and test the chemicalite extension | |
| shell: bash -l {0} | |
| run: | | |
| conda activate chemicalite-build | |
| cmake --debug-output -D CMAKE_BUILD_TYPE=${{ matrix.build-type }} . | |
| cmake --build . --config ${{ matrix.build-type }} | |
| ls $PWD/src | |
| PATH=$PWD/src:$PATH ctest -C ${{ matrix.build-type }} --output-on-failure | |
| conda deactivate | |
| # Destroy the build environment | |
| - name: Destroy the build environment | |
| shell: bash -l {0} | |
| run: conda remove -n chemicalite-build --all |