renkin 0.15.5

Ultra-fast retrosynthesis engine for computer-aided synthesis planning (CASP) — pure Rust, WASM-ready, Python bindings via PyO3
Documentation 
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34

[build-system]
requires = ["maturin>=1.0,<2.0"]
build-backend = "maturin"

[project]
name = "renkin"
version = "0.15.4"
description = "Ultra-fast retrosynthesis engine for computer-aided synthesis planning (CASP) — pure Rust, Python bindings via PyO3"
readme = "README.md"
license = { text = "MIT" }
requires-python = ">=3.8"
keywords = ["retrosynthesis", "cheminformatics", "chemistry", "drug-discovery", "casp"]
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.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"