main.yml

name: run_tests
on:
  push:
    paths:
      - "**.py"
      - "Makefile"
      - "openbabel/**"
      - "eigen/**"
      - "src/**"
  pull_request:
  workflow_dispatch:
jobs:
  build:
    runs-on: ubuntu-latest
    steps:
      - uses: actions/checkout@v4
      - name: Setup Python 3.10
        uses: actions/setup-python@v5
        with:
          python-version: "3.10"
      - name: Install colordiff
        run: |
          sudo apt-get update
          sudo apt-get install colordiff 
      - name: Build Project 
        run: |
          mkdir Output
          make test
      - name: Run Unit Tests
        run: make unittest
      - name: Run Intermediate Tests
        run : make intermediatetest
      - name: Archive Mismatch Artifacts
        uses: actions/upload-artifact@v4
        with:
          name: mismatch
          path: Mismatch
          if-no-files-found: ignore
          retention-days: 1
      - name: Run Integration Tests
        run: |
          python set_paths.py
          pip install .
          make pytest