pyproject.toml

[build-system]
requires = ["wheel", "scikit-build-core"]
build-backend = "scikit_build_core.build"

[project]
name = "raspa"
version = "3.0.0"
description = "A general purpose classical simulation package"
authors = [
    { name = "Drs. Youri Ran, University of Amsterdam" },
    { name = "Drs. Shrinjay Sharma, Delft University of Technology" },
    { name = "Drs. Zhao Li, Northwestern University" },
    { name = "Prof. Sofia Calero, Eindhoven University of Technology" },
    { name = "Prof. Thijs Vlugt, Delft University of Technology" },
    { name = "Prof. Randall Q. Snurr, Northwestern University" },
    { name = "Dr. David Dubbeldam, University of Amsterdam", email = "d.dubbeldam@uva.nl" },
]
dependencies = ["pybind11", "numpy"]
requires-python = ">=3.10"
license = { file = "LICENSE.md" }
readme = "README.md"


[tool.scikit-build]
cmake.version = ">=3.28"
cmake.build-type = "Release"
cmake.args = [
    "--preset=python",
    "-DBUILD_TESTING=0",
    "-DBUILD_PYTHON=1",
    "-DSKIP_EXECUTABLE=1",
]
wheel.cmake = true
build-dir = "build/python"
sdist.exclude = ["*.cpp", "*.ixx", "*.pcm", "CMakeLists.txt"]