MDRestraintsGenerator/.github/workflows/deploy.yaml at master · IAlibay/MDRestraintsGenerator · GitHub

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name: Build and upload to PyPI

on:
  push:
    tags:
      - "*"
  release:
    types:
      - published


concurrency:
  group: "${{ github.ref }}-${{ github.head_ref }}-${{ github.workflow }}"
  cancel-in-progress: true


defaults:
  run:
    shell: bash -l {0}


jobs:
  build_wheels_testpypi:
    environment: deploy
    if: |
      github.repository == 'IAlibay/MDRestraintsGenerator' &&
      (github.event_name == 'push' && startsWith(github.ref, 'refs/tags/'))
    name: Build pure Python wheel
    runs-on: ubuntu-latest

    steps:
      - uses: actions/checkout@v3
        with:
          fetch-depth: 0

      - name: setup_miniconda
        uses: conda-incubator/setup-miniconda@v2
        with:
          python-version: 3.8
          auto-update-conda: true
          add-pip-as-python-dependency: true
          architecture: x64

      - name: install_deps
        run: |
          python -m pip install build

      - name: build
        run: |
          python -m build --sdist --wheel --outdir dist/

      - name: publish_testpypi
        uses: pypa/gh-action-pypi-publish@release/v1
        with:
          password: ${{ secrets.TEST_PYPI_API_TOKEN }}
          repository_url: https://test.pypi.org/legacy/

  build_wheels_pypi:
    environment: deploy
    if: |
      github.repository == 'IAlibay/MDRestraintsGenerator' &&
      (github.event_name == 'release' && github.event.action == 'published')
    name: Build pure Python wheel
    runs-on: ubuntu-latest

    steps:
      - uses: actions/checkout@v3
        with:
          fetch-depth: 0

      - name: setup_miniconda
        uses: conda-incubator/setup-miniconda@v2
        with:
          python-version: 3.8
          auto-update-conda: true
          add-pip-as-python-dependency: true
          architecture: x64

      - name: install_deps
        run: |
          python -m pip install build

      - name: build
        run: |
          python -m build --sdist --wheel --outdir dist/

      - name: publish_pypi
        uses: pypa/gh-action-pypi-publish@release/v1
        with:
          password: ${{ secrets.PYPI_API_TOKEN }}

  test_testpypi:
    if: |
      github.repository == 'IAlibay/MDRestraintsGenerator' &&
      (github.event_name == 'push' && startsWith(github.ref, 'refs/tags/'))
    name: testpypi check
    runs-on: ${{ matrix.os }}
    needs: build_wheels_testpypi
    strategy:
      fail-fast: false
      matrix:
        os: [ubuntu-latest, macos-latest]
        python-version: ["3.8", "3.9", "3.10"]
    env:
      MPLBACKEND: agg

    steps:
      - uses: actions/checkout@v3

      - name: setup_miniconda
        uses: conda-incubator/setup-miniconda@v2
        with:
          python-version: ${{ matrix.python-version }}
          auto-update-conda: true
          channel-priority: flexible
          channels: conda-forge
          add-pip-as-python-dependency: true
          architecture: x64

      - name: install_test_deps
        run: |
          pip install pytest pytest-xdist

      - name: pip_install
        run: |
          pip install --index-url https://test.pypi.org/simple/ --extra-index-url https://pypi.org/simple MDRestraintsGenerator

      - name: test
        run: |
          pytest --pyargs MDRestraintsGenerator.tests