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0.5.0 syntheseus-0.5.0-py3-none-any.whl

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Project: syntheseus
Version: 0.5.0
Filename: syntheseus-0.5.0-py3-none-any.whl
Download: [link]
Size: 170187
MD5: 20c793625fb16c3cc5b5c2fef599b011
SHA256: e479d3aed60d388c50e069fddacf2cae4a00e83a2321a8746f9f6f8a18fa897e
Uploaded: 2024-11-28 16:09:55 +0000

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

METADATA

Metadata-Version: 2.1
Name: syntheseus
Version: 0.5.0
Summary: A package for retrosynthetic planning.
Author: Austin Tripp, Krzysztof Maziarz, Guoqing Liu, Megan Stanley, Marwin Segler
Project-Url: Documentation, https://microsoft.github.io/syntheseus
Project-Url: Repository, https://github.com/microsoft/syntheseus
License: MIT License Copyright (c) Microsoft Corporation. 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
Requires-Python: >=3.7
Requires-Dist: more_itertools
Requires-Dist: networkx
Requires-Dist: numpy
Requires-Dist: omegaconf
Requires-Dist: rdkit
Requires-Dist: tqdm
Requires-Dist: typing_extensions; python_version < "3.8"
Requires-Dist: pillow; extra == "viz"
Requires-Dist: graphviz; extra == "viz"
Requires-Dist: pytest; extra == "dev"
Requires-Dist: pytest-cov; extra == "dev"
Requires-Dist: pre-commit; extra == "dev"
Requires-Dist: syntheseus-chemformer (==0.2.0); extra == "chemformer"
Requires-Dist: syntheseus-graph2edits (==0.2.0); extra == "graph2edits"
Requires-Dist: syntheseus-local-retro (==0.5.0); extra == "local-retro"
Requires-Dist: syntheseus-megan (==0.1.0); extra == "megan"
Requires-Dist: syntheseus-mhnreact (==1.0.0); extra == "mhn-react"
Requires-Dist: syntheseus[local-retro]; extra == "retro-knn"
Requires-Dist: syntheseus-root-aligned (==0.1.0); extra == "root-aligned"
Requires-Dist: syntheseus[chemformer,graph2edits,local-retro,megan,mhn-react,retro-knn,root-aligned]; extra == "all-single-step"
Requires-Dist: syntheseus[all-single-step,dev,viz]; extra == "all"
Provides-Extra: viz
Provides-Extra: dev
Provides-Extra: chemformer
Provides-Extra: graph2edits
Provides-Extra: local-retro
Provides-Extra: megan
Provides-Extra: mhn-react
Provides-Extra: retro-knn
Provides-Extra: root-aligned
Provides-Extra: all-single-step
Provides-Extra: all
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 5095 characters]

WHEEL

Wheel-Version: 1.0
Generator: setuptools (75.6.0)
Root-Is-Purelib: true
Tag: py3-none-any

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syntheseus-0.5.0.dist-info/top_level.txt sha256=OzCgDfD9wR5FFfJSxdLQk0SbTM7KH4sIjMPCuEaLnic 11
syntheseus-0.5.0.dist-info/RECORD — —

top_level.txt

syntheseus

entry_points.txt

[console_scripts]
syntheseus = syntheseus.cli.main:main