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# Copyright 2013-2024 Lawrence Livermore National Security, LLC and other
# Spack Project Developers. See the top-level COPYRIGHT file for details.
#
# SPDX-License-Identifier: (Apache-2.0 OR MIT)
from spack.package import *
class PyPanedr(PythonPackage):
"""Panedr uses the Pyedr library to read a Gromacs EDR binary energy XDR file and returns
its contents as a pandas dataframe"""
homepage = "https://github.com/MDAnalysis/panedr"
pypi = "panedr/panedr-0.7.1.tar.gz"
maintainers("RMeli")
license("LGPL-2.1-or-later")
version("0.7.2", sha256="2181009a962dc35745348d1146608c64fb1ba3ef5ae74043416fef739d1409e4")
version("0.7.1", sha256="64c74863f72d51729ac5cb1e2dbb18747f7137588990c308ef8ca120fbf2ddd4")
# PyEDR is released together with PanEDR, therefore versions should match
depends_on("py-pyedr@0.7.2", type=("build", "run"), when="@0.7.2")
depends_on("py-pyedr@0.7.1", type=("build", "run"), when="@0.7.1")
depends_on("py-pandas", type=("build", "run"))
depends_on("py-pbr", type=("build", "run"))
depends_on("py-setuptools", type="build")
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