update check_intermediate to use check_file.py and compare molecule a… #31

	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 and Run All Tests
	run: \|
	mkdir Output
	python set_paths.py
	pip install .
	make test

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