pyproject.toml

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

[project]
name = "fragfold"
version = "0.0.1"
description = ""
readme = "README.md"
requires-python = ">=3.7"
license = {file = "LICENSE.txt"}
keywords = ["fragfold","fragments","peptide","binding","alphafold"]
authors = [
  {name = "Andrew Savinov", email = "savinov@mit.edu"},
  {name = "Sebastian Swanson", email = "swans@mit.edu"}
]
maintainers = [
  {name = "Andrew Savinov", email = "savinov@mit.edu"},
  {name = "Sebastian Swanson", email = "swans@mit.edu"}
]
dependencies = [
  "biopython",
  "freesasa",
  "jupyter",
  "numpy<=2.0.0",
  "pandas",
  "scipy",
  "seaborn",
]

[tool.setuptools.packages.find]
where = ["."]  # list of folders that contain the packages (["."] by default)
include = ["fragfold","fragfold.src"]  # package names should match these glob patterns (["*"] by default)
exclude = []  # exclude packages matching these glob patterns (empty by default)
namespaces = false  # to disable scanning PEP 420 namespaces (true by default)

[project.urls]
Repository = "https://github.com/swanss/FragFold.git"