test.yaml

name: test

on: 
  push:
  pull_request:
  workflow_dispatch:

jobs:
  test:
    runs-on: ubuntu-latest
    strategy:
      fail-fast: false

    steps:
      # Repository
      - name: Checkout the code
        uses: actions/checkout@v4

      # Environment
      - name: Download environment files
        run: |
          wget https://raw.githubusercontent.com/Auto-Mech/amech-dev/main/pixi.toml
          wget https://raw.githubusercontent.com/Auto-Mech/amech-dev/main/pixi.lock

      - name: Set up Pixi
        uses: prefix-dev/setup-pixi@v0.8.1

      - name: Pip install
        run: |
          pixi run pip install git+https://github.com/Auto-Mech/autochem.git
          pixi run pip install -e . --no-deps

      # Test
      - name: Test
        run: |
          pixi run pytest -v autoparse
          pixi run pytest -v autoread
          pixi run pytest -v autowrite
          pixi run pytest -v ioformat
          pixi run pytest -v chemkin_io
          pixi run pytest -v projrot_io
          pixi run pytest -v polyrate_io
          pixi run pytest -v thermp_io
          pixi run pytest -v onedmin_io
          # # broken:
          # pixi run pytest -v pac99_io   # ! fix
          # pixi run pytest -v varecof_io # ! fix
          # pixi run pytest -v mess_io    # ! FIX !
          # pixi run pytest -v autorun    # ! fix
          # pixi run pytest -v elstruct   # ! fix