Stars
Simultaneous global fitting for spectroscopy
Interactive textbook on state-space models
A Python library of algorithms for the baseline correction of experimental data.
A tool for Smart Multi-modal Characterization of molecules, leveraging contrastive learning to align structural (graph) and vibrational (IR, Raman) information.
Python implementation of domain-invariant partial least squares regression (di-PLS)
Templates for jupyter notebooks
Python library for chemometric data analysis
The Biorefinery Simulation and Techno-Economic Analysis Modules
Read chromatography and mass spectrometry binary files.
SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python
GitPython is a python library used to interact with Git repositories.
Next-gen fast plotting library running on WGPU using the pygfx rendering engine
A Python library for anomaly detection across tabular, time series, graph, text, image, and audio data. 60+ detectors, benchmark-backed ADEngine orchestration, and an agentic workflow for AI agents.
Chemometric analysis methods implemented in python
👽 Out-of-Distribution Detection with PyTorch
A Python library for unevenly-spaced time series analysis
ruptures: change point detection in Python
High order and sparse layers in pytorch. Lagrange Polynomial, Piecewise Lagrange Polynomial, Piecewise Discontinuous Lagrange Polynomial (Chebyshev nodes) and Fourier Series layers of arbitrary ord…
The repository provides code for running inference with the SegmentAnything Model (SAM), links for downloading the trained model checkpoints, and example notebooks that show how to use the model.
Deep Learning models applied to the analysis of VIS-NIR spectral data
PyTorch Lightning + Hydra. A very user-friendly template for ML experimentation. ⚡🔥⚡
Center-based model of cartilage formation and growth