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plots

plots #432

Workflow file for this run

name: CI
on:
# GitHub has started calling new repo's first branch "main" https://github.com/github/renaming
# Existing codes likely still have "master" as the primary branch
# Both are tracked here to keep legacy and new codes working
push:
branches:
- "main"
pull_request:
branches:
- "main"
schedule:
# Midnight Tuesdays and Fridays
- cron: "0 0 * * 2,5"
concurrency:
# Probably overly cautious group naming.
# Commits to develop/master will cancel each other, but PRs will only cancel
# commits within the same PR
group: "${{ github.ref }}-${{ github.head_ref }}"
cancel-in-progress: true
jobs:
lint:
runs-on: ubuntu-latest
steps:
- uses: actions/checkout@v4
- uses: actions/setup-python@v5
with:
python-version: "3.9"
cache: pip
cache-dependency-path: pyproject.toml
- uses: pre-commit/[email protected]
with:
extra_args: --files solvation_analysis/*
test:
name: pip install on ${{ matrix.os }}, Python ${{ matrix.python-version }}
runs-on: ${{ matrix.os }}
strategy:
fail-fast: false
matrix:
os: [macOS-latest, ubuntu-latest, windows-latest]
python-version: [3.9, "3.10", 3.11, 3.12]
steps:
- uses: actions/checkout@v3
- uses: actions/setup-python@v4
with:
python-version: ${{ matrix.python-version }}
- name: Install package
run: |
python -m pip install .
- name: Run tests
run: |
pytest -v --color=yes solvation_analysis/tests/
- name: CodeCov
uses: codecov/codecov-action@v1
with:
file: ./coverage.xml
flags: unittests
name: codecov-${{ matrix.os }}-py${{ matrix.python-version }}