qmllib/Makefile at main · qmlcode/qmllib · GitHub

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all: .venv

install:
	uv pip install -e .[test,dev] --verbose

install-native:
	CMAKE_ARGS="-DQMLLIB_USE_NATIVE=ON" uv pip install -e .[test,dev] --verbose

install-dev:
	uv pip install -e .[test,dev] --verbose
	uv run pre-commit install

test:
	uv run pytest -m "not integration" tests/ -v -s

test-all:
	uv run pytest tests/ -v -s

.venv:
	uv venv --python 3.14
	# These are sometimes missed in GitHub CI builds
	uv pip install scikit-build-core pybind11

check: format types

format:
	uv run ruff format src/ tests/
	uv run ruff check --fix --verbose src/ tests/

types:
	uv run ty check src/ --exclude tests/

monkeytype:
	uv run monkeytype run -m pytest ./tests -m "not integration"
	uv run monkeytype list-modules | grep qmllib | xargs -I{} uv run monkeytype apply {}

stubs:
	mkdir -p stubs_temp
	uv run stubgen -p qmllib._fdistance -o stubs_temp
	uv run stubgen -p qmllib._fgradient_kernels -o stubs_temp
	uv run stubgen -p qmllib._fkernels -o stubs_temp
	uv run stubgen -p qmllib._facsf -o stubs_temp
	uv run stubgen -p qmllib._representations -o stubs_temp
	uv run stubgen -p qmllib._fslatm -o stubs_temp
	uv run stubgen -p qmllib._solvers -o stubs_temp
	uv run stubgen -p qmllib._utils -o stubs_temp
	uv run stubgen -p qmllib.representations.fchl.ffchl_module -o stubs_temp
	mv stubs_temp/qmllib/*.pyi src/qmllib/
	mv stubs_temp/qmllib/representations/fchl/ffchl_module/*.pyi src/qmllib/representations/fchl/
	rm -rf stubs_temp
	uv run ruff format src/qmllib/

build:
	uv build --sdist

test-dist: build
	uv run twine check dist/*

clean:
	find ./src/ -type f \( \
		-name "*.so" -o \
		-name "*.pyc" -o \
		-name "*.pyo" -o \
		-name "*.mod" \
	\) -delete
	rm -rf ./src/*.egg-info/
	rm -rf *.whl
	rm -rf ./build/ ./__pycache__/
	rm -rf ./dist/

clean-env:
	rm -rf ./.venv/
	rm -rf ./.git/hooks/pre-commit