Curie-Web/.github/workflows/test-plip-oddt.yaml

name: Test Curie Functions

on: [push]

jobs:
  build:

    runs-on: ubuntu-20.04
    if: "! contains(github.event.head_commit.message, 'wip')"
    strategy:
      matrix:
        python-version: [3.8]
    steps:
    - uses: actions/checkout@v2
    - name: Set up Python ${{ matrix.python-version }}
      uses: actions/setup-python@v2
      with:
        python-version: ${{ matrix.python-version }}
    - name: Install dependencies
      run: |
        sudo apt update && sudo apt install python3-openbabel openbabel git
        python -m pip install --upgrade pip
        python3 -m pip install git+https://github.com/navanchauhan/plip oddt
    - name: Clean Test Data
      run: cd tests && python test-oddt-plip.py