[build-system]
requires = ["setuptools>=61.0", "wheel"]
build-backend = "setuptools.build_meta"

[project]
name = "modular-rfdiffusion"
version = "0.1.0"
description = "Modular Diffusers Pipeline for RFDiffusion protein structure generation"
readme = "README.md"
license = {text = "Apache-2.0"}
requires-python = ">=3.8"
authors = [
    {name = "Dhruv Nair"}
]
keywords = ["diffusion", "protein", "rfdiffusion", "deep-learning", "pytorch"]
classifiers = [
    "Development Status :: 3 - Alpha",
    "Intended Audience :: Science/Research",
    "License :: OSI Approved :: Apache Software License",
    "Programming Language :: Python :: 3",
    "Programming Language :: Python :: 3.8",
    "Programming Language :: Python :: 3.9",
    "Programming Language :: Python :: 3.10",
    "Programming Language :: Python :: 3.11",
    "Topic :: Scientific/Engineering :: Artificial Intelligence",
    "Topic :: Scientific/Engineering :: Bio-Informatics",
]

dependencies = [
    "torch>=2.0.0",
    "numpy>=1.21.0",
    "diffusers>=0.25.0",
    "huggingface-hub>=0.20.0",
    "scipy>=1.7.0",
    "hydra-core>=1.0.0",
    "omegaconf>=2.0.0",
]

[project.optional-dependencies]
dev = [
    "pytest>=7.0.0",
    "pytest-cov>=4.0.0",
    "black>=23.0.0",
    "ruff>=0.1.0",
    "mypy>=1.0.0",
]

[project.urls]
Homepage = "https://github.com/DN6/modular-diffusers"
Repository = "https://github.com/DN6/modular-diffusers"

[tool.setuptools.packages.find]
where = ["."]
include = ["*"]

[tool.black]
line-length = 119
target-version = ["py38", "py39", "py310", "py311"]

[tool.ruff]
line-length = 119
target-version = "py38"

[tool.ruff.lint]
select = ["E", "F", "W", "I", "N"]
ignore = ["E501"]