Notes on the Red Pitaya Open Source Instrument

MATLAB package of iterative regularization methods and large-scale test problems. This software is described in the paper "IR Tools: A MATLAB Package of Iterative Regularization Methods and Large-Scale Test Problems" that will be published in Numerical Algorithms, 2018.

Galaxy tools for metabolomics maintained by Workflow4Metabolomics

This project attempts to construct a missing well log from other available well logs, more specifically an NMR well log from the measured Gamma Ray (GR), Caliper, Resistivity logs and the interpreted porosity from a well.

React component to display and process nuclear magnetic resonance (NMR) spectra.

Visualization and Analysis of mass spectrometric and chromatographic data.

SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python

R functions for the chemometric analysis of spectra

ChemEx is an analysis program for chemical exchange detected by NMR.

Soprano - a Python library to crack crystals!

A fast solid-state NMR spectrum simulation and analysis library.

QE-GIPAW for Quantum-Espresso (official repository)

The MetaRbolomics book. A review of R packages in BioC, CRAN, gitlab and github.

Program for the simULation of nuclear Spin Ensemble Evolution

SPIKE a collaborative development for a FT-spectroscopy processing program.

BioEn - Bayesian Inference Of ENsembles

Reference implemention of the IUPAC JCAMP-DX spectroscopy data standard. Fork of https://sourceforge.net/projects/jcamp-dx/

FOSS Resources for Spectroscopy

A software suite for automatic treatment, analysis and plotting of large and multivariable datasets of bioNMR peaklists.

A Python library for NMR simulation