switch repo to openmm org in download wheel script + other fixes #81
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| # This file was generated automatically from conda-smithy. To update this configuration, | |
| # update the conda-forge.yml and/or the recipe/meta.yaml. | |
| # -*- mode: yaml -*- | |
| name: Build conda package | |
| on: | |
| push: | |
| pull_request: | |
| concurrency: | |
| group: ${{ github.workflow }}-${{ github.event.pull_request.number || github.sha }} | |
| cancel-in-progress: true | |
| jobs: | |
| build: | |
| name: ${{ matrix.CONFIG }} | |
| runs-on: ${{ matrix.runs_on }} | |
| timeout-minutes: 360 | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| include: | |
| - CONFIG: linux_64_c_compiler_version10cuda_compilernvcccuda_compiler_version11.2cxx_compiler_version10numpy1.22python3.10.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.2 | |
| - CONFIG: linux_64_c_compiler_version10cuda_compilernvcccuda_compiler_version11.2cxx_compiler_version10numpy1.22python3.8.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.2 | |
| - CONFIG: linux_64_c_compiler_version10cuda_compilernvcccuda_compiler_version11.2cxx_compiler_version10numpy1.22python3.9.____73_pypypython_implpypy | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.2 | |
| - CONFIG: linux_64_c_compiler_version10cuda_compilernvcccuda_compiler_version11.2cxx_compiler_version10numpy1.22python3.9.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.2 | |
| - CONFIG: linux_64_c_compiler_version10cuda_compilernvcccuda_compiler_version11.2cxx_compiler_version10numpy1.23python3.11.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.2 | |
| - CONFIG: linux_64_c_compiler_version10cuda_compilernvcccuda_compiler_version11.2cxx_compiler_version10numpy1.26python3.12.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.2 | |
| - CONFIG: linux_64_c_compiler_version11cuda_compilernvcccuda_compiler_version11.8cxx_compiler_version11numpy1.22python3.10.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.8 | |
| - CONFIG: linux_64_c_compiler_version11cuda_compilernvcccuda_compiler_version11.8cxx_compiler_version11numpy1.22python3.8.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.8 | |
| - CONFIG: linux_64_c_compiler_version11cuda_compilernvcccuda_compiler_version11.8cxx_compiler_version11numpy1.22python3.9.____73_pypypython_implpypy | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.8 | |
| - CONFIG: linux_64_c_compiler_version11cuda_compilernvcccuda_compiler_version11.8cxx_compiler_version11numpy1.22python3.9.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.8 | |
| - CONFIG: linux_64_c_compiler_version11cuda_compilernvcccuda_compiler_version11.8cxx_compiler_version11numpy1.23python3.11.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.8 | |
| - CONFIG: linux_64_c_compiler_version11cuda_compilernvcccuda_compiler_version11.8cxx_compiler_version11numpy1.26python3.12.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cuda:11.8 | |
| - CONFIG: linux_64_c_compiler_version12cuda_compilercuda-nvcccuda_compiler_version12.0cxx_compiler_version12numpy1.22python3.10.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cos7-x86_64 | |
| - CONFIG: linux_64_c_compiler_version12cuda_compilercuda-nvcccuda_compiler_version12.0cxx_compiler_version12numpy1.22python3.8.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cos7-x86_64 | |
| - CONFIG: linux_64_c_compiler_version12cuda_compilercuda-nvcccuda_compiler_version12.0cxx_compiler_version12numpy1.22python3.9.____73_pypypython_implpypy | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cos7-x86_64 | |
| - CONFIG: linux_64_c_compiler_version12cuda_compilercuda-nvcccuda_compiler_version12.0cxx_compiler_version12numpy1.22python3.9.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cos7-x86_64 | |
| - CONFIG: linux_64_c_compiler_version12cuda_compilercuda-nvcccuda_compiler_version12.0cxx_compiler_version12numpy1.23python3.11.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cos7-x86_64 | |
| - CONFIG: linux_64_c_compiler_version12cuda_compilercuda-nvcccuda_compiler_version12.0cxx_compiler_version12numpy1.26python3.12.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: ubuntu | |
| runs_on: ['ubuntu-latest'] | |
| DOCKER_IMAGE: quay.io/condaforge/linux-anvil-cos7-x86_64 | |
| - CONFIG: osx_64_numpy1.22python3.10.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_64_numpy1.22python3.8.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_64_numpy1.22python3.9.____73_pypypython_implpypy | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_64_numpy1.22python3.9.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_64_numpy1.23python3.11.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_64_numpy1.26python3.12.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_arm64_numpy1.22python3.10.____cpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_arm64_numpy1.22python3.8.____cpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_arm64_numpy1.22python3.9.____cpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_arm64_numpy1.23python3.11.____cpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: osx_arm64_numpy1.26python3.12.____cpython | |
| UPLOAD_PACKAGES: True | |
| os: macos | |
| runs_on: ['macos-latest'] | |
| - CONFIG: win_64_cuda_compilercuda-nvcccuda_compiler_version12.0numpy1.22python3.10.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilercuda-nvcccuda_compiler_version12.0numpy1.22python3.8.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilercuda-nvcccuda_compiler_version12.0numpy1.22python3.9.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilercuda-nvcccuda_compiler_version12.0numpy1.23python3.11.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilercuda-nvcccuda_compiler_version12.0numpy1.26python3.12.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.2numpy1.22python3.10.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.2numpy1.22python3.8.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.2numpy1.22python3.9.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.2numpy1.23python3.11.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.2numpy1.26python3.12.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.8numpy1.22python3.10.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.8numpy1.22python3.8.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.8numpy1.22python3.9.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.8numpy1.23python3.11.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| - CONFIG: win_64_cuda_compilernvcccuda_compiler_version11.8numpy1.26python3.12.____cpythonpython_implcpython | |
| UPLOAD_PACKAGES: True | |
| os: windows | |
| runs_on: ['windows-latest'] | |
| steps: | |
| - name: Manage disk space | |
| if: matrix.os == 'ubuntu' | |
| run: | | |
| sudo mkdir -p /opt/empty_dir || true | |
| for d in \ | |
| /opt/ghc \ | |
| /opt/hostedtoolcache \ | |
| /usr/lib/jvm \ | |
| /usr/local/.ghcup \ | |
| /usr/local/lib/android \ | |
| /usr/local/share/powershell \ | |
| /usr/share/dotnet \ | |
| /usr/share/swift \ | |
| ; do | |
| sudo rsync --stats -a --delete /opt/empty_dir/ $d || true | |
| done | |
| sudo apt-get purge -y -f firefox \ | |
| google-chrome-stable \ | |
| microsoft-edge-stable | |
| sudo apt-get autoremove -y >& /dev/null | |
| sudo apt-get autoclean -y >& /dev/null | |
| df -h | |
| - name: Checkout code | |
| uses: actions/checkout@v4 | |
| - name: Build on Linux | |
| if: matrix.os == 'ubuntu' | |
| env: | |
| CONFIG: ${{ matrix.CONFIG }} | |
| UPLOAD_PACKAGES: ${{ matrix.UPLOAD_PACKAGES }} | |
| DOCKER_IMAGE: ${{ matrix.DOCKER_IMAGE }} | |
| CI: github_actions | |
| CONDA_FORGE_DOCKER_RUN_ARGS: "${{ matrix.CONDA_FORGE_DOCKER_RUN_ARGS }}" | |
| BINSTAR_TOKEN: ${{ secrets.BINSTAR_TOKEN }} | |
| FEEDSTOCK_TOKEN: ${{ secrets.FEEDSTOCK_TOKEN }} | |
| STAGING_BINSTAR_TOKEN: ${{ secrets.STAGING_BINSTAR_TOKEN }} | |
| shell: bash | |
| run: | | |
| echo "::group::Configure binfmt_misc" | |
| docker run --rm --privileged multiarch/qemu-user-static:register --reset --credential yes | |
| export flow_run_id="github_$GITHUB_RUN_ID" | |
| export remote_url="https://github.com/$GITHUB_REPOSITORY" | |
| export sha="$GITHUB_SHA" | |
| export FEEDSTOCK_NAME="$(basename $GITHUB_REPOSITORY)" | |
| export GIT_BRANCH="$(basename $GITHUB_REF)" | |
| if [[ "${GITHUB_EVENT_NAME}" == "pull_request" ]]; then | |
| export IS_PR_BUILD="True" | |
| else | |
| export IS_PR_BUILD="False" | |
| fi | |
| echo "::endgroup::" | |
| ./.scripts/run_docker_build.sh | |
| - name: Build on macOS | |
| if: matrix.os == 'macos' | |
| env: | |
| CONFIG: ${{ matrix.CONFIG }} | |
| UPLOAD_PACKAGES: ${{ matrix.UPLOAD_PACKAGES }} | |
| CI: github_actions | |
| BINSTAR_TOKEN: ${{ secrets.BINSTAR_TOKEN }} | |
| FEEDSTOCK_TOKEN: ${{ secrets.FEEDSTOCK_TOKEN }} | |
| STAGING_BINSTAR_TOKEN: ${{ secrets.STAGING_BINSTAR_TOKEN }} | |
| shell: bash | |
| run: | | |
| export flow_run_id="github_$GITHUB_RUN_ID" | |
| export remote_url="https://github.com/$GITHUB_REPOSITORY" | |
| export sha="$GITHUB_SHA" | |
| export FEEDSTOCK_NAME="$(basename $GITHUB_REPOSITORY)" | |
| export GIT_BRANCH="$(basename $GITHUB_REF)" | |
| if [[ "${GITHUB_EVENT_NAME}" == "pull_request" ]]; then | |
| export IS_PR_BUILD="True" | |
| else | |
| export IS_PR_BUILD="False" | |
| fi | |
| ./.scripts/run_osx_build.sh | |
| - name: Install Miniconda for windows | |
| uses: conda-incubator/setup-miniconda@v2 | |
| with: | |
| miniforge-version: latest | |
| miniforge-variant: Mambaforge | |
| if: matrix.os == 'windows' | |
| - name: Build on windows | |
| shell: cmd | |
| run: | | |
| set "flow_run_id=github_%GITHUB_RUN_ID%" | |
| set "remote_url=https://github.com/%GITHUB_REPOSITORY%" | |
| set "sha=%GITHUB_SHA%" | |
| call ".scripts\run_win_build.bat" | |
| env: | |
| PYTHONUNBUFFERED: 1 | |
| CONFIG: ${{ matrix.CONFIG }} | |
| CI: github_actions | |
| UPLOAD_PACKAGES: ${{ matrix.UPLOAD_PACKAGES }} | |
| BINSTAR_TOKEN: ${{ secrets.BINSTAR_TOKEN }} | |
| FEEDSTOCK_TOKEN: ${{ secrets.FEEDSTOCK_TOKEN }} | |
| STAGING_BINSTAR_TOKEN: ${{ secrets.STAGING_BINSTAR_TOKEN }} | |
| if: matrix.os == 'windows' | |
| - name: Upload artifacts to Github | |
| uses: actions/upload-artifact@v4 | |
| with: | |
| path: build_artifacts/pypi_wheels | |
| name: ${{ matrix.CONFIG }} | |
| overwrite: true | |
| - name: Upload artifacts to Github release | |
| uses: svenstaro/upload-release-action@v2 | |
| with: | |
| repo_token: ${{ secrets.GITHUB_TOKEN }} | |
| file: build_artifacts/pypi_wheels/*.whl | |
| tag: ${{ github.ref }} | |
| overwrite: false | |
| file_glob: true | |
| if: startsWith(github.ref, 'refs/tags/') |