Regioselectivity filter, modified rxn rules, profitability index in ranking and visualization #84

	name: validation
	on:
	pull_request:
	push:
	branches:
	- main
	- release

	concurrency:
	group: ${{ github.workflow }}-${{ github.head_ref \|\| github.run_id}}
	cancel-in-progress: true

	jobs:
	build:
	runs-on: ${{ matrix.os }}-latest
	strategy:
	matrix:
	os: [macos, ubuntu, windows]
	python-version: ["3.10", "3.11", "3.12"]

	steps:
	- uses: actions/checkout@v4
	- name: Set up Python ${{ matrix.python-version }}
	uses: actions/setup-python@v5
	with:
	cache: "pip"
	python-version: ${{ matrix.python-version }}
	- name: Install dependencies
	run: \|
	python -m pip install --upgrade pip
	pip install .
	pip list
	- name: Lint with Ruff
	run: \|
	pip install .[lint]
	ruff check --output-format=github .
	ruff format --diff .
	- name: Type check with Mypy
	run: \|
	pip install .[lint]
	mypy --no-install-types .
	- name: Test doranet with pytest
	run: \|
	pip install .[test]
	pytest

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