Name | rgpycrumbs JSON |
Version |
0.0.1
JSON |
| download |
home_page | None |
Summary | Input file generators for computational chemistry |
upload_time | 2024-11-26 14:32:21 |
maintainer | None |
docs_url | None |
author | None |
requires_python | >=3.10 |
license | MIT |
keywords |
parsers
plots
|
VCS |
|
bugtrack_url |
|
requirements |
No requirements were recorded.
|
Travis-CI |
No Travis.
|
coveralls test coverage |
No coveralls.
|
# Table of Contents
- [About](#orgd7704b6)
- [License](#org98dc3f2)
<a id="orgd7704b6"></a>
# About
![img](branding/logo/pycrumbs_logo.webp)
[![Hatch project](https://img.shields.io/badge/%F0%9F%A5%9A-Hatch-4051b5.svg)](https://github.com/pypa/hatch)
A **pure-python** module of helpful scripts / CLIs I have written mostly for quick
and dirty parsing / plotting of optimization methods. Loosely grouped. Not
optimal at all.
Most of these rely heavily on optional dependencies, with the exception of the
`_aux` helpers (pure Python).
<a id="org98dc3f2"></a>
# License
MIT. However, this is an academic resource, so **please cite** as much as possible
via:
- The Zenodo DOI for general use.
- The `wailord` paper for ORCA usage
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