name: unit tests

on:
  pull_request:
  push:
    branches:
      - master
  schedule:
    - cron: '0 0 * * *'

jobs:
  build:

    runs-on: ubuntu-latest
    strategy:
      fail-fast: false
      matrix:
        python-version: [3.6, 3.8]
        test-filenames: [
          test_aev.py, test_aev_benzene_md.py, test_aev_nist.py, test_aev_tripeptide_md.py,
          test_utils.py, test_ase.py, test_energies.py, test_periodic_table_indexing.py,
          test_neurochem.py, test_vibrational.py, test_ensemble.py, test_padding.py,
          test_data.py, test_forces.py, test_structure_optim.py, test_jit_builtin_models.py, 
          test_grad.py, test_cuaev.py]

    steps:
    - uses: actions/checkout@v1
    - name: Set up Python ${{ matrix.python-version }}
      uses: actions/setup-python@v1
      with:
        python-version: ${{ matrix.python-version }}
    - name: Fetch submodules
      run: git submodule update --init
    - name: Install dependencies
      run: ci/install_dependencies.sh
    - name: Install TorchANI
      run: python setup.py install
    - name: Download data files
      run: ./download.sh
    - name: Run single test
      run: python tests/${{ matrix.test-filenames }} -v