pytest.yml

name: Testing

on: [push, pull_request]

jobs:
  build:
    strategy:
      max-parallel: 1
      matrix:
        os: [ubuntu-latest]
        python-version: ['3.10']

    runs-on: ${{ matrix.os }}

    steps:
      - uses: actions/checkout@v3

      - uses: conda-incubator/setup-miniconda@v2
        with:
          python-version: ${{ matrix.python-version }}

      - name: Install OpenBabel
        shell: bash -l {0}
        run: conda install -c conda-forge openbabel

      - name: Install dependencies
        shell: bash -l {0}
        run: |
          python -m pip install --upgrade pip
          pip install -r requirements.txt
          pip install -r requirements-ci.txt
          pip install .
      - name: pytest
        shell: bash -l {0}
        env:
          PMG_MAPI_KEY: ${{ secrets.PMG_MAPI_KEY }}
          MPLBACKEND: "Agg"
        run: |
          pytest custodian --color=yes