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{
lib,
buildPythonPackage,
fetchFromGitHub,
# build-system
scikit-build-core,
cython,
oldest-supported-numpy,
# nativeBuildInputs
cmake,
ninja,
# buildInputs
onetbb,
nanobind,
# dependencies
numpy,
rowan,
scipy,
parsnip,
# tests
pytestCheckHook,
python,
gsd,
matplotlib,
sympy,
}:
buildPythonPackage rec {
pname = "freud";
version = "3.5.0";
pyproject = true;
src = fetchFromGitHub {
owner = "glotzerlab";
repo = "freud";
tag = "v${version}";
hash = "sha256-NRI3cv3yQxAwkGxh0CFYEERNkjP51Z58vtCV9GlIESY=";
fetchSubmodules = true;
};
# Because we prefer to not `leaveDotGit`, we need to fool upstream into
# thinking we left the .git files in the submodules, so cmake won't think we
# didn't initialize them. Upstream doesn't support using the system wide
# installed version of these libraries, and it's probably aint's worth the
# hassle, because upstream also doesn't distribute all of these dependencies'
# libraries, and probably it uses only what it needs.
preConfigure = ''
touch extern/{voro++,fsph,Eigen}/.git
'';
build-system = [
scikit-build-core
cython
oldest-supported-numpy
];
nativeBuildInputs = [
cmake
ninja
];
dontUseCmakeConfigure = true;
buildInputs = [
onetbb
nanobind
];
dependencies = [
numpy
rowan
scipy
parsnip
];
nativeCheckInputs = [
pytestCheckHook
gsd
matplotlib
sympy
];
# On top of cd $out due to https://github.com/NixOS/nixpkgs/issues/255262 ,
# we need to also copy the tests because otherwise pytest won't find them.
preCheck = ''
cp -R tests $out/${python.sitePackages}/freud/tests
cd $out
'';
pythonImportsCheck = [ "freud" ];
meta = {
description = "Powerful, efficient particle trajectory analysis in scientific Python";
homepage = "https://github.com/glotzerlab/freud";
changelog = "https://github.com/glotzerlab/freud/blob/${src.tag}/ChangeLog.md";
license = lib.licenses.bsd3;
maintainers = with lib.maintainers; [ doronbehar ];
};
}
|
