renkin 0.35.0

Ultra-fast retrosynthesis engine for computer-aided synthesis planning (CASP) — pure Rust, WASM-ready, Python bindings via PyO3
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[build-system]
requires = ["maturin>=1.0,<2.0"]
build-backend = "maturin"

[project]
name = "renkin"
version = "0.35.0"
description = "Local retrosynthesis route auditor and planning engine for AiZynthFinder, Syntheseus and RENKIN"
readme = "README.md"
license = { text = "MIT" }
requires-python = ">=3.8"
keywords = [
    "retrosynthesis",
    "route-audit",
    "route-validation",
    "aizynthfinder",
    "syntheseus",
    "casp",
    "cheminformatics",
]
classifiers = [
    "Development Status :: 3 - Alpha",
    "Intended Audience :: Science/Research",
    "License :: OSI Approved :: MIT License",
    "Topic :: Scientific/Engineering :: Chemistry",
    "Programming Language :: Python :: 3",
    "Programming Language :: Python :: 3.8",
    "Programming Language :: Python :: 3.9",
    "Programming Language :: Python :: 3.10",
    "Programming Language :: Python :: 3.11",
    "Programming Language :: Python :: 3.12",
    "Programming Language :: Rust",
]

[project.optional-dependencies]
# Declared dependency interval: >=0.7.2,<=0.8.0 (this admits any
# intermediate release too, e.g. a hypothetical future 0.7.3 -- it is
# not restricted to exactly these two version strings). Individually
# verified against real PyPI artifacts: only 0.7.2 and 0.8.0 (see
# docs/design/syntheseus-0.8-compatibility-spike.md). The upper bound is
# deliberately capped at 0.8.0, not an open-ended <0.9 or unpinned: an
# unverified future release above the verified range (0.8.1, 0.9.0, ...)
# must not be silently accepted just because it would likely still work
# -- verified and supported are not the same claim. An intermediate
# release within the interval (0.7.3..0.7.9, if any are ever published)
# is accepted by this spec but is not individually verified unless added
# to the exact-version CI matrix.
syntheseus = ["syntheseus>=0.7.2,<=0.8.0"]

[project.urls]
Homepage   = "https://github.com/kent-tokyo/renkin"
Repository = "https://github.com/kent-tokyo/renkin"
Issues     = "https://github.com/kent-tokyo/renkin/issues"

[tool.maturin]
features      = ["python"]
module-name   = "renkin"
python-source = "python"