pyproject.toml

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

[project]
name = "InstructMol"
version = "1.0.1"
description = "InstructMol: Multi-Modal Integration for Building a Versatile and Reliable Molecular Assistant in Drug Discovery"
readme = "README.md"
requires-python = ">=3.8"
classifiers = [
    "Programming Language :: Python :: 3",
    "License :: OSI Approved :: Apache Software License",
]
dependencies = [
    "einops", "fastapi", "gradio==3.35.2", "markdown2[all]", "numpy",
    "requests", "sentencepiece", "tokenizers>=0.12.1",
    "torchvision", "uvicorn", "wandb",
    "shortuuid", "httpx==0.24.0",
    "deepspeed==0.9.5",
    "peft==0.4.0",
    "transformers==4.31.0",
    "accelerate==0.21.0",
    "bitsandbytes==0.41.0",
    "scikit-learn==1.2.2",
    "sentencepiece==0.1.99",
    "einops==0.6.1", "einops-exts==0.0.4", "timm==0.6.13",
    "gradio_client==0.2.9"
]

[tool.setuptools.packages.find]
exclude = ["assets*", "benchmark*", "docs", "dist*", "playground*", "scripts*", "tests*"]

[tool.wheel]
exclude = ["assets*", "benchmark*", "docs", "dist*", "playground*", "scripts*", "tests*"]