Specifiable options for periodic neighbors calculations #59

	name: Run data related PyTests
	permissions: {}

	env:
	COLUMNS: 120
	on:
	pull_request:
	paths:
	- 'matsciml/datasets/**'
	- 'matsciml/lightning/data_utils.py'
	workflow_dispatch:
	jobs:
	dataset-pytest:
	runs-on: ubuntu-latest
	steps:
	- uses: actions/checkout@v4
	- name: Create/reuse micromamba env
	uses: mamba-org/setup-micromamba@v1
	with:
	micromamba-version: '1.5.7-0'
	environment-file: conda.yml
	init-shell: >-
	bash
	cache-environment: true
	post-cleanup: 'all'
	generate-run-shell: true
	- name: Install current version of matsciml
	run: \|
	pip install .
	shell: micromamba-shell {0}
	- name: Install PyTest
	run: \|
	pip install pytest pytest-dependency pytest-pretty
	shell: micromamba-shell {0}
	- name: Print out environment
	run: \|
	micromamba env export && pip freeze
	shell: micromamba-shell {0}
	- name: Run pytest in data
	run: \|
	pytest -v -m "not lmdb and not slow and not remote_request" ./matsciml/datasets ./matsciml/lightning/
	shell: micromamba-shell {0}

Provide feedback