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0.6.1 alchemiscale-0.6.1-py3-none-any.whl

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Project: alchemiscale
Version: 0.6.1
Filename: alchemiscale-0.6.1-py3-none-any.whl
Download: [link]
Size: 151146
MD5: 1fd7bcac1fffc8853ab1533ed4a3d0d8
SHA256: 52d641d2db62c9ce7afeaa73e10797379d9b2e7fc368e32e70b1ee025e22d2a6
Uploaded: 2025-02-28 00:42:45 +0000

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METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt

METADATA

Metadata-Version: 2.2
Name: alchemiscale
Version: 0.6.1
Summary: a high-throughput alchemical free energy execution system for use with HPC, cloud, bare metal, and Folding@Home
Author: OpenFE and OpenFF developers
Project-Url: Homepage, https://github.com/OpenFreeEnergy/alchemiscale
License: MIT
Classifier: Development Status :: 4 - Beta
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: POSIX
Classifier: Programming Language :: Python :: 3
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Requires-Python: >=3.9
Requires-Dist: pytest; extra == "test"
Requires-Dist: pytest-xdist; extra == "test"
Provides-Extra: test
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 1771 characters]

WHEEL

Wheel-Version: 1.0
Generator: setuptools (75.8.2)
Root-Is-Purelib: true
Tag: py3-none-any

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alchemiscale-0.6.1.dist-info/RECORD — —

top_level.txt

alchemiscale

entry_points.txt

[console_scripts]
alchemiscale = alchemiscale.cli:cli