Data from recent publications
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Updated
May 24, 2024 - Jupyter Notebook
Data from recent publications
pyAMARES, an Open-Source Python Library for Fitting Magnetic Resonance Spectroscopy Data
SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python
A fast solid-state NMR spectrum simulation and analysis library.
React component to display and process nuclear magnetic resonance (NMR) spectra.
QE-GIPAW for Quantum-Espresso (official repository)
Visualization and Analysis of mass spectrometric and chromatographic data.
The software for NMR experiments analysis
Linear inversion of two-dimensional isotropic-anisotropic NMR correlation spectrum.
CoNSEnsX - Complience of NMR-derived Structural Ensembles with Experimental Data
hyperSpec: Tools for Spectroscopy (R package)
nmrXiv is currently developed as the FAIR, consensus-driven NMR data repository and computational platform. The ultimate goal is to accelerate broader coordination and data sharing among natural product (NP) researchers by enabling storage, management, sharing and analysis of NMR data.
DNPLab - Bringing the power of Python to DNP-NMR Spectroscopy
Python library to process Spinsolve experiments
Galaxy tools for metabolomics maintained by Workflow4Metabolomics
Cods for processing data obtained with NMR-MOUSE of Magritek. Include Inverse Laplace Transform algorithm (FISTA) and plots.
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