PyRank

Chemometrics Python Packages

Python packages with the GitHub topic chemometrics. Sorted by relevance, with stars and monthly downloads.
cthoyt
chembl-downloader

Write reproducible code for getting and processing ChEMBL

5K 91 14
barahona-research-group
ramanspy

RamanSPy: An open-source Python package for integrative Raman spectroscopy data analysis

2K 183 33
BiRG
pyopls

A Python 3 implementation of orthogonal projection to latent structures

2K 65 20
DTUComputeStatisticsAndDataAnalysis
mbpls

(Multiblock) Partial Least Squares Regression for Python

1K 33 8
ALebrun-108
boxsers

Python package that provides a full range of functionality to process and analyze vibrational spectra (Raman, SERS, FTIR, etc.).

951 76 15
chandrasekarnarayana
foodspec

Headless, research-grade Python toolkit for Raman and FTIR spectroscopy in food science.

784 1 0
Gscorreia89
pychemometrics

pyChemometrics - Objects for multivariate analysis of chemometric and metabonomic datasets

716 40 15
maruedt
chemometrics

Python library for chemometric data analysis

569 39 6
B-Analytics
diplslib

Python package for domain adaptation in multivariate regression

418 23 13
olivertomic
hoggorm

Explorative multivariate statistics in Python

416 80 25
jeffrichardchemistry
molbokeh

A new python package to visualize molecules in dots hover

236 13 1
dijsilva
preprocspectra

No description available

178 5 2
HaasCP
mocca

Deprecated open-source Python project to analyze HPLC–DAD raw data.

106 42 11
habeeb3579
spectoprep

A comprehensive spectral preprocessing toolkit for chemometrics

99 1 0