fengwanwan / alphafold3

AlphaFold3

Learn AlphaFold3 inspired from AlphaFold3 https://github.com/kyegomez/AlphaFold3.git. Many thanks Eternal Reclaimer.

Installation

You can install the package using pip

Code Quality 🧹

• make style to format the code
• make check_code_quality to check code quality (PEP8 basically)
• black .
• ruff . --fix

Tests 🧪

pytests is used to run our tests.

Publish on PyPi 🚀

Important: Before publishing, edit __version__ in src/init to match the wanted new version.

poetry build
poetry publish

CI/CD 🤖

We use GitHub actions to automatically run tests and check code quality when a new PR is done on main.

On any pull request, we will check the code quality and tests.

When a new release is created, we will try to push the new code to PyPi. We use twine to make our life easier.

The correct steps to create a new realease are the following:

• edit __version__ in src/init to match the wanted new version.
• create a new tag with the release name, e.g. git tag v0.0.1 && git push origin v0.0.1 or from the GitHub UI.
• create a new release from GitHub UI

The CI will run when you create the new release.

Docs

We use MK docs. This repo comes with the zeta docs. All the docs configurations are already here along with the readthedocs configs.

License

MIT