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0.4.16 tscode-0.4.16-py3-none-any.whl

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Project: tscode
Version: 0.4.16
Filename: tscode-0.4.16-py3-none-any.whl
Download: [link]
Size: 428380
MD5: 105cf20a241735189d705e7443ee2a56
SHA256: a103f61ce3f22879b482c11753e55f1596b413a18015a102ff27d1389c039a33
Uploaded: 2024-04-02 17:44:16 +0000

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METADATA · WHEEL · RECORD · top_level.txt

METADATA

Metadata-Version: 2.1
Name: tscode
Version: 0.4.16
Summary: Computational chemistry general purpose transition state builder and ensemble optimizer
Author: Nicolò Tampellini
Author-Email: nicolo.tampellini[at]yale.edu
Home-Page: https://www.github.com/ntampellini/tscode
Keywords: computational chemistry,ASE,transition state,xtb
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.8
Classifier: License :: OSI Approved :: GNU General Public License v3 (GPLv3)
Classifier: Operating System :: OS Independent
Requires-Python: >=3.8
Requires-Dist: numpy
Requires-Dist: scipy
Requires-Dist: numba-scipy (==0.3.0)
Requires-Dist: cclib (==1.7)
Requires-Dist: periodictable (==1.6.0)
Requires-Dist: matplotlib (==3.4.2)
Requires-Dist: networkx (==2.5.1)
Requires-Dist: rmsd (==1.4)
Requires-Dist: ase (==3.21.1)
Requires-Dist: sella (==2.3.2)
Requires-Dist: scikit-learn (==1.0.1)
Requires-Dist: numba (==0.54.1)
Requires-Dist: prettytable (==3.3.0)
Requires-Dist: typing-extensions (==4.8.0)
Requires-Dist: llvmlite
Requires-Dist: importlib-metadata (==7.0.1)
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 24049 characters]

WHEEL

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Tag: py3-none-any

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tscode-0.4.16.dist-info/RECORD — —

top_level.txt

tscode