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pyberny

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0.6.3 pyberny-0.6.3-py3-none-any.whl

Wheel Details

Project: pyberny
Version: 0.6.3
Filename: pyberny-0.6.3-py3-none-any.whl
Download: [link]
Size: 27401
MD5: 6ea535b85d04678f9ea07c32e4adbfa9
SHA256: edb37aee86cc0f607b88b7f504dc6708a3eb167c6fc48a7d36bb9f92d0302a1d
Uploaded: 2021-02-22 19:48:36 +0000

dist-info

METADATA · WHEEL · RECORD · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: pyberny
Version: 0.6.3
Summary: Molecular/crystal structure optimizer
Author: Jan Hermann
Author-Email: dev[at]jan.hermann.name
Home-Page: https://github.com/jhrmnn/pyberny
Project-Url: Documentation, https://jhrmnn.github.io/pyberny
Project-Url: Repository, https://github.com/jhrmnn/pyberny
License: MPL-2.0
Classifier: Environment :: Console
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved
Classifier: Operating System :: POSIX
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.5
Classifier: Programming Language :: Python :: 3.6
Classifier: Programming Language :: Python :: 3.7
Classifier: Programming Language :: Python :: 3.8
Classifier: Programming Language :: Python :: 3.9
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Topic :: Scientific/Engineering :: Physics
Requires-Python: >=3.5,<4.0
Requires-Dist: coverage (<5.0,>=4.5); extra == "test"
Requires-Dist: numpy (<2.0,>=1.15)
Requires-Dist: pytest (<4.0,>=3.6); extra == "test"
Requires-Dist: sphinx (<3.0,>=2.2); extra == "doc"
Requires-Dist: sphinxcontrib-katex (<0.6.0,>=0.5.1); extra == "doc"
Requires-Dist: toml (<0.11.0,>=0.10.0); extra == "doc"
Provides-Extra: doc
Provides-Extra: test
Description-Content-Type: text/markdown
[Description omitted; length: 2682 characters]

WHEEL

Wheel-Version: 1.0
Generator: poetry 1.0.0
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

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berny/coords.py sha256=GmSvtzSoec_pdVnhoR49OiSIOU1NH22xL7UU1qPxnNw 15934
berny/geomlib.py sha256=BEN7H0WDQeM9S8k7jg818FgsBUcCPRx8ABxwAKhl8M4 11144
berny/optimize.py sha256=xJ3VX8rmBpNlk9F7Al-RnMHwnzk8A7ksSw98vYZxc50 1701
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berny/species-data.csv sha256=zP8cHRcWMb1WkvnRasuEkJ6mJTEKEUzS4Zq3_rjIlCc 3727
berny/species_data.py sha256=W6M1kI482rD7-98AQ8si63ORtd6ksPlJq7gQxTgY3zQ 835
pyberny-0.6.3.dist-info/entry_points.txt sha256=hOBqSVAPP5OU9e6sBQcWt7gdThgHXvTzOvFDb7M-qqk 40
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pyberny-0.6.3.dist-info/RECORD — —

entry_points.txt

[console_scripts]
berny = berny.cli:main