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pyproject.toml
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pyproject.toml
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[build-system]
requires = ["hatchling"]
build-backend = "hatchling.build"
[project]
name = "MDDPN"
version = "0.0.2"
authors = [{ name = "Egor Perevoshchikov", email = "abkein@abkein.ru" }]
description = "A package for continiously running LAMMPS on HPC systems with SLURM workload manager, where execution time is limited"
readme = "README.md"
license = { text = "MIT License" }
requires-python = ">=3.8"
classifiers = [
"Development Status :: 3 - Alpha",
"Intended Audience :: Education",
"Intended Audience :: Science/Research",
"Programming Language :: Python :: 3",
"License :: OSI Approved :: MIT License",
"Operating System :: Unix",
"Topic :: Scientific/Engineering :: Physics",
"Topic :: Scientific/Engineering :: Chemistry",
]
dependencies = ['MPMU >= 0.0.2', 'pysbatch-ng >= 0.0.1', 'toml']
[project.scripts]
MDDPN = "MDDPN.ssd:main"
[project.urls]
"Homepage" = "https://github.com/Architect0rr/MDDPN"
"Bug Tracker" = "https://github.com/Architect0rr/MDDPN/issues"