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openmm-mdanalysis-reporter

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0.1 openmm_mdanalysis_reporter-0.1-py3-none-any.whl

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Project: openmm-mdanalysis-reporter
Version: 0.1
Filename: openmm_mdanalysis_reporter-0.1-py3-none-any.whl
Download: [link]
Size: 140298
MD5: bdf6aae044e65bf8e2fe5553a575f999
SHA256: 04b731c4529be1948bbb8ebd04cc977aea7139f87a5a91568f4e20d8723e0529
Uploaded: 2023-05-25 21:24:14 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt

METADATA

Metadata-Version: 2.1
Name: openmm-mdanalysis-reporter
Version: 0.1
Summary: MDAnalysis based reporter for OpenMM
Author: Stephen Farr
Author-Email: Stephen Farr <stephen.farr[at]ed.ac.uk>
Maintainer-Email: Stephen Farr <stephen.farr[at]ed.ac.uk>
License: MIT License Copyright (c) 2023 Stephen Farr Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to deal in the Software without restriction, including without limitation the rights to use, copy, modify, merge, publish, distribute, sublicense, and/or sell copies of the Software, and to permit persons to whom the Software is furnished to do so, subject to the following conditions: The above copyright notice and this permission notice shall be included in all copies or substantial portions of the Software. THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY, FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM, OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE SOFTWARE.
Keywords: molecular simulations
Requires-Python: >=3.9
Requires-Dist: MDAnalysis (>=2.0.0)
Requires-Dist: sphinx; extra == "doc"
Requires-Dist: sphinx-rtd-theme; extra == "doc"
Requires-Dist: pytest (>=6.0); extra == "test"
Requires-Dist: pytest-xdist (>=2.5); extra == "test"
Requires-Dist: pytest-cov (>=3.0); extra == "test"
Provides-Extra: doc
Provides-Extra: test
Description-Content-Type: text/markdown
License-File: LICENSE
License-File: AUTHORS.md
[Description omitted; length: 6130 characters]

WHEEL

Wheel-Version: 1.0
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Root-Is-Purelib: true
Tag: py3-none-any

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openmm_mdanalysis_reporter-0.1.dist-info/RECORD — —

top_level.txt

mdareporter