sbd-eigensolver-python/pyproject.toml at main · Qiskit/sbd-eigensolver-python · GitHub

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[build-system]
requires = ["setuptools>=77", "wheel", "pybind11>=2.6.0", "mpi4py>=3.0.0"]
build-backend = "setuptools.build_meta"

[project]
name = "sbd-eigensolver"
version = "1.6.1"
description = "Python bindings for Selected Basis Diagonalization (SBD) library"
readme = "README.md"
requires-python = ">=3.10"
license = "Apache-2.0"
license-files = ["LICENSE.txt"]
keywords = ["quantum chemistry", "diagonalization", "tensor product basis", "MPI"]
classifiers = [
    "Development Status :: 4 - Beta",
    "Intended Audience :: Science/Research",
    "Topic :: Scientific/Engineering :: Chemistry",
    "Topic :: Scientific/Engineering :: Physics",
    "Programming Language :: Python :: 3",
    "Programming Language :: Python :: 3.10",
    "Programming Language :: Python :: 3.11",
    "Programming Language :: Python :: 3.12",
    "Programming Language :: Python :: 3.13",
    "Programming Language :: Python :: 3.14",
    "Programming Language :: C++",
]
dependencies = [
    "pybind11>=2.6.0",
    "mpi4py>=3.0.0",
    "numpy>=1.19.0",
]

[project.optional-dependencies]
basetest = [
    "pytest>=8.0",
]
test = [
    "sbd-eigensolver[basetest]",
    "pytest-mpi>=0.6",
]
nbtest = [
    "sbd-eigensolver[basetest]",
    "nbmake>=1.5.0",
]
notebook-dependencies = [
    "qiskit-addon-sqd>=0.13.1",
    "pyscf>=2.9",
]

[project.urls]
Homepage = "https://github.com/Qiskit/sbd-eigensolver-python"
Documentation = "https://github.com/Qiskit/sbd-eigensolver-python"
Repository = "https://github.com/Qiskit/sbd-eigensolver-python"
Issues = "https://github.com/Qiskit/sbd-eigensolver-python/issues"

[tool.setuptools]
# The extension modules (and their MPI/BLAS/NVHPC build logic) are declared
# imperatively in setup.py; everything else lives in [project] above.
packages = ["sbd"]
package-dir = {sbd = "python"}
zip-safe = false

[tool.pytest.ini_options]
testpaths = ["test"]
# -rs lists the skipped tests and why, which matters here because most of the suite
# skips by default: a bare count of skips would not distinguish "this case is slow" or
# "this backend was not built" from "the reference data is missing". --durations shows
# where the time goes, the cases differing by orders of magnitude in cost.
addopts = "-rs --durations=10"