31 lines
900 B
Python
31 lines
900 B
Python
# Copyright 2013-2024 Lawrence Livermore National Security, LLC and other
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# Spack Project Developers. See the top-level COPYRIGHT file for details.
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#
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# SPDX-License-Identifier: (Apache-2.0 OR MIT)
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from spack.package import *
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class Tinker(CMakePackage):
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"""The Tinker molecular modeling software is a complete and general
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package for molecular mechanics and dynamics, with some special
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features for biopolymers.
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"""
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homepage = "https://dasher.wustl.edu/tinker/"
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url = "https://dasher.wustl.edu/tinker/downloads/tinker-8.7.1.tar.gz"
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version("8.7.2", sha256="f9e94ae0684d527cd2772a4a7a05c41864ce6246f1194f6c1c402a94598151c2")
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version(
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"8.7.1",
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sha256="0d6eff8bbc9be0b37d62b6fd3da35bb5499958eafe67aa9c014c4648c8b46d0f",
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deprecated=True,
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)
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patch("tinker-8.7.1-cmake.patch")
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depends_on("fftw")
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root_cmakelists_dir = "source"
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