Metadata-Version: 2.1
Name: PyChrom
Version: 0.0.4
Summary: Module to provide tools to process and analyse chromatographic data from different sources such as UPLC, LCMS, GCMS, etc.
Home-page: https://github.com/rdgsnm/PyChrom
Author: Rodrigo Silva Nascimento Mancini
Author-email: rdgsnm@gmail.com
License: MIT
Keywords: chromatography,chemometrics,data preprocessing
Platform: UNKNOWN
Classifier: Development Status :: 3 - Alpha
Classifier: Intended Audience :: Science/Research
Classifier: Operating System :: Microsoft :: Windows :: Windows 11
Classifier: License :: OSI Approved :: MIT License
Classifier: Natural Language :: English
Classifier: Programming Language :: Python :: 3.10
Classifier: Topic :: Scientific/Engineering :: Chemistry
License-File: LICENSE

This is a module to aid in processing of liquid chromatography data.
It includes an easy interface to perform many operations required to process and analyse
chromatography data, such as:\n
0- Smoothing\n
1- Baseline correction\n
2- Search for peak and determine the width at a given relative height\n
3- Detect fused peaks and determine the start and end of each of them\n
4- Peak purity\n


Changelog
=========
0.0.4 (09/25/2022)
------------------
- Corrected noise calculation
- Two options: raw noise and normalized noise

0.0.3 (09/25/2022)
------------------
- Fixed some functions and docstrings
- Added new function calculate_noise
    Calculate noise allows the determination of instrumental noise based on the
    calculation of the standard deviation considering the raw data as the input and
    the smoothed data as the mean

0.0.2 (09/11/2022)
------------------
- Corrected bugs and some fixes to functions (type hintings and enhanced docstrings)

0.0.1 (09/11/2022)
------------------
- First release

