Metadata-Version: 2.4
Name: pyphyschemtools
Version: 0.5.0
Summary: A comprehensive Python toolbox for physical chemistry and cheminformatics
Author-email: "Romuald POTEAU, LPCNO" <romuald.poteau@utoulouse.fr>
Project-URL: Repository, https://github.com/rpoteau/pyphyschemtools
Project-URL: Changelog, https://github.com/rpoteau/pyphyschemtools/blob/main/CHANGELOG.md
Project-URL: Documentation, https://pyphyschemtools.readthedocs.io/en/latest/
Project-URL: Issues, https://github.com/rpoteau/pyphyschemtools/issues
Requires-Python: >=3.8
Description-Content-Type: text/markdown
License-File: LICENSE
Requires-Dist: bokeh
Requires-Dist: CageCavityCalc
Requires-Dist: ipywidgets
Requires-Dist: jupyter
Requires-Dist: matplotlib
Requires-Dist: mendeleev
Requires-Dist: numpy
Requires-Dist: openpyxl
Requires-Dist: pandas
Requires-Dist: Pillow
Requires-Dist: pubchempy
Requires-Dist: py3Dmol
Requires-Dist: rdkit
Requires-Dist: scikit-learn
Requires-Dist: scipy
Provides-Extra: docs
Requires-Dist: sphinx; extra == "docs"
Requires-Dist: sphinx_rtd_theme; extra == "docs"
Requires-Dist: myst-parser; extra == "docs"
Requires-Dist: nbsphinx; extra == "docs"
Requires-Dist: ipykernel; extra == "docs"
Requires-Dist: pandoc; extra == "docs"
Requires-Dist: numpydoc; extra == "docs"
Dynamic: license-file

<div style="text-align:center">
<img src="https://raw.githubusercontent.com/rpoteau/pyphyschemtools/main/pyphyschemtools/icons_logos_banner/tools4pyPC_banner.png" alt="t4pyPCbanner" width="800"/>
</div>

<br>

**pyphyschemtools** is a collection of Python utilities designed to facilitate data processing and analysis in the field of physical chemistry. This library is an integral part of the broader [**pyPhysChem project**](https://github.com/rpoteau/pyPhysChem/), aimed at providing open-source, reproducible tools for researchers and students.



---

**Installation**

Activate your python environment and run:

```bash
pip install pyphyschem
