pyproject.toml

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

[tool.setuptools.packages.find]
where = ["src"]

[tool.setuptools.package-data]
mofsynth = ["*"]
"mofsynth.input_data" = ["*"]

[tool.setuptools.dynamic]
version = {attr = "mofsynth.__version__"}

[project]
name = "mofsynth"
dynamic = ["version"]

authors = [
  {name="Charalampos G. Livas", email="livas.charalampos@gmail.com"},
]

license = {text = "GPL-3.0-only"}
description = "Package for MOF synthesizability evaluation."
readme = "README.md"
requires-python = ">=3.10"

classifiers = [
    "Programming Language :: Python :: 3",
	"License :: OSI Approved :: GNU General Public License v3 (GPLv3)",
    "Operating System :: POSIX :: Linux",
]

dependencies = [
	"matplotlib>=3.7.1",
	"numpy>=1.24.1",
	"pymatgen>=2023.5.10",
 	"openpyxl>=3.1.2",
  	"rmsd>=1.5.1"
]

[project.urls]
Homepage = "https://github.com/livaschar/mofsynth"