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1.1.1 nanoreactor_processing-1.1.1-py3-none-any.whl

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Project: nanoreactor-processing
Version: 1.1.1
Filename: nanoreactor_processing-1.1.1-py3-none-any.whl
Download: [link]
Size: 17184
MD5: 7b0c0cbc1e2e36bd316705a88a40c9d3
SHA256: 70cf9ba08a2a8371a786afaaa18ddd6dbc8e27228a23999f578e575e9d623768
Uploaded: 2022-11-09 13:21:52 +0000

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METADATA · WHEEL · RECORD · top_level.txt

METADATA

Metadata-Version: 2.1
Name: nanoreactor-processing
Version: 1.1.1
Summary: Automated evaluation of computational nanoreactor simulations
Author: Alexandra Stan
Author-Email: alexandra.stan[at]cup.uni-muenchen.de
Home-Page: https://github.com/ochsenfeld-lab/nanoreactor_processing
Download-Url: https://github.com/ochsenfeld-lab/nanoreactor_processing/archive/refs/heads/main.zip
License: MIT
Keywords: computational chemistry,automated,molecular dynamics,chemical reactions,ab initio nanoreactor,rdkit
Classifier: Development Status :: 5 - Production/Stable
Classifier: Environment :: Console
Classifier: License :: OSI Approved :: MIT License
Classifier: Programming Language :: Python :: 3.8
Requires-Dist: numpy (>=1.23.1)
Requires-Dist: scipy (>=1.8.1)
Requires-Dist: pandas (>=1.4.3)
Requires-Dist: networkx (>=2.8.4)
Requires-Dist: matplotlib (>=3.5.2)
Requires-Dist: seaborn (>=0.11.2)
Requires-Dist: pyvis (>=0.2.1)
Requires-Dist: rdkit-pypi (==2021.3.4)
Description-Content-Type: text/markdown
License-File: LICENSE.md
[Description omitted; length: 3345 characters]

WHEEL

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top_level.txt

nanoreactor_processing