fix docs build, update build framework

.github/workflows/test.yml

@@ -112,8 +112,7 @@ jobs:
     - id: dist
       uses: casperdcl/deploy-pypi@v2
       with:
-        requirements: twine setuptools wheel setuptools_scm[toml] scikit-build
-        build: sdist
+        build: -s
         password: ${{ secrets.PYPI_TOKEN }}
         upload: ${{ github.event_name == 'push' && startsWith(github.ref, 'refs/tags') }}
     - if: github.event_name == 'push' && startsWith(github.ref, 'refs/tags')

.gitignore

@@ -2,7 +2,7 @@
 __pycache__/
 
 # build
-MANIFEST
+/MANIFEST.in
 /*.egg*/
 *.so
 /numcu/cmake/

.pre-commit-config.yaml

@@ -36,14 +36,15 @@ repos:
     - flake8-comprehensions
     - flake8-debugger
     - flake8-isort
+    - flake8-pyproject
     - flake8-string-format
 - repo: https://github.com/pre-commit/mirrors-mypy
-  rev: v1.1.1
+  rev: v1.3.0
   hooks:
   - id: mypy
     additional_dependencies: [types-setuptools]
 - repo: https://github.com/google/yapf
-  rev: v0.32.0
+  rev: v0.33.0
   hooks:
   - id: yapf
     args: [-i]

README.rst

@@ -14,7 +14,7 @@ Install
 
 Requirements:
 
-- Python 3.7 or greater (e.g. via `Anaconda or Miniconda <https://docs.conda.io/projects/conda/en/latest/user-guide/install/download.html#anaconda-or-miniconda>`_ or via `python3-dev`)
+- Python 3.7 or greater (e.g. via `Anaconda or Miniconda <https://docs.conda.io/projects/conda/en/latest/user-guide/install/download.html#anaconda-or-miniconda>`_, or via ``python3-dev``)
 - (optional) `CUDA SDK/Toolkit <https://developer.nvidia.com/cuda-downloads>`_ (including drivers for an NVIDIA GPU)
 
   * note that if the CUDA SDK/Toolkit is installed *after* NumCu, then NumCu must be re-installed to enable CUDA support
@@ -40,8 +40,8 @@ Licence
 
 Copyright:
 
-- `Casper O. da Costa-Luis <https://github.com/casperdcl>`__ @ University College London/King's College London
-- `Contributors <https://github.com/AMYPAD/numcu/graphs/contributors>`__
+- `Casper O. da Costa-Luis <https://github.com/casperdcl>`_
+- `Contributors <https://github.com/AMYPAD/numcu/graphs/contributors>`_
 
 .. |DOI| image:: https://zenodo.org/badge/DOI/10.5281/zenodo.7013340.svg
    :target: https://doi.org/10.5281/zenodo.7013340

docs/requirements.txt

@@ -2,6 +2,6 @@
 mkdocs-material<8.1.3
 git+https://github.com/tqdm/jsmin@python3-only#egg=jsmin
 mkdocs-minify-plugin
-pydoc-markdown>=4
+pydoc-markdown>=4,!=4.8.0
 pygments
 pymdown-extensions>=9

pyproject.toml

@@ -2,7 +2,80 @@
 requires = ["setuptools>=42", "wheel", "setuptools_scm[toml]>=3.4",
             "cuvec>=2.11.0", "miutil[cuda]>=0.4.0",
             "scikit-build>=0.11.0", "cmake>=3.18", "ninja"]
+build-backend = "setuptools.build_meta"
 
 [tool.setuptools_scm]
 write_to = "numcu/_dist_ver.py"
 write_to_template = "__version__ = '{version}'\n"
+
+[project.urls]
+documentation = "https://amypad.github.io/NumCu"
+repository = "https://github.com/AMYPAD/NumCu"
+changelog = "https://github.com/AMYPAD/NumCu/releases"
+
+[project]
+name = "numcu"
+dynamic = ["version"]
+authors = [{name = "Casper da Costa-Luis", email = "casper.dcl@physics.org"}]
+description = "Numerical CUDA-based Python library built on CuVec"
+readme = "README.rst"
+requires-python = ">=3.7"
+keywords = ["Python", "C", "C++", "buffer", "vector", "array", "CUDA", "CPython", "SWIG", "extensions", "API"]
+license = {text = "MPL-2.0"}
+classifiers = [
+    "Development Status :: 5 - Production/Stable",
+    "Intended Audience :: Developers",
+    "Environment :: GPU",
+    "Environment :: GPU :: NVIDIA CUDA",
+    "Intended Audience :: Education",
+    "Intended Audience :: Science/Research",
+    "License :: OSI Approved :: Mozilla Public License 2.0 (MPL 2.0)",
+    "Operating System :: Microsoft :: Windows",
+    "Operating System :: POSIX :: Linux",
+    "Programming Language :: C",
+    "Programming Language :: C++",
+    "Programming Language :: Python :: 3",
+    "Programming Language :: Python :: 3.7",
+    "Programming Language :: Python :: 3.8",
+    "Programming Language :: Python :: 3.9",
+    "Programming Language :: Python :: 3.10",
+    "Programming Language :: Python :: 3.11",
+    "Programming Language :: Python :: 3 :: Only",
+    "Topic :: Software Development :: Libraries",
+    "Topic :: Software Development :: Libraries :: Python Modules",
+    "Topic :: Utilities"]
+dependencies = ['importlib_resources; python_version < "3.9"', "cuvec>=2.11.0", "numpy"]
+
+[project.optional-dependencies]
+dev = ["pytest>=6", "pytest-cov", "pytest-timeout", "pytest-xdist"]
+
+[tool.flake8]
+max_line_length = 99
+extend_ignore = ["E261", "E701"]
+exclude = [".git", "__pycache__", "build", "dist", ".eggs"]
+
+[tool.yapf]
+spaces_before_comment = [15, 20]
+arithmetic_precedence_indication = true
+allow_split_before_dict_value = false
+coalesce_brackets = true
+column_limit = 99
+each_dict_entry_on_separate_line = false
+space_between_ending_comma_and_closing_bracket = false
+split_before_named_assigns = false
+split_before_closing_bracket = false
+blank_line_before_nested_class_or_def = false
+
+[tool.isort]
+profile = "black"
+line_length = 99
+multi_line_output = 4
+known_first_party = ["numcu", "tests"]
+
+[tool.pytest.ini_options]
+minversion = "6.0"
+timeout = 30
+log_level = "INFO"
+python_files = ["tests/test_*.py"]
+testpaths = ["tests"]
+addopts = "-v --tb=short -rxs -W=error -n=2 --durations=0 --durations-min=1 --cov=numcu --cov-report=term-missing --cov-report=xml"

setup.py

@@ -14,7 +14,7 @@
 log = logging.getLogger("numcu.setup")
 
 build_ver = ".".join(__version__.split('.')[:3]).split(".dev")[0]
-cmake_args = [f"-DNUMCU_BUILD_VERSION={build_ver}", f"-DPython3_ROOT_DIR={sys.prefix}"]
+cmake_args = [f"-DNUMCU_BUILD_VERSION={build_ver}"]
 try:
     from miutil import cuinfo
     nvcc_arch_raw = map(cuinfo.compute_capability, range(cuinfo.num_devices()))