Tools for quantitative analysis of nuclear magnetic resonance (NMR) spectra using the Wasserstein metric.
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Updated
Mar 24, 2026 - Jupyter Notebook
Tools for quantitative analysis of nuclear magnetic resonance (NMR) spectra using the Wasserstein metric.
A repository containing programs for determining the intensity calibration curve (or the wavelength sensitivity) for Raman spectrometers (and more) from the rotational Raman spectra of diatomic hydrogen and its isotopes.
Forth code, Microprocessor Z80, CP/M-Version adapted at Institute for Applied Physics, University of Bonn
A Python program for the analysis of transient absorption spectroscopy data. Disclaimer: This was a bachelors thesis and our first coding project in python. Code may or may not be disgusting at times.
SPECTROview : A Tool for Spectroscopic Data Processing and Visualization.
Procedures (for IgorPro) to perform operations needed in day to day analysis of spectroscopic data. For example, Raman or infrared spectra where the data is structured as array of 1-D or 2-D waves.
Data for magnetstein paper & web application. For more info see: https://github.com/BDomzal/magnetstein.
Conversion for Raman Spectroscopy
Employing Magnetstein for the analysis of chemical reactions.
Code for the analysis of spectroscopic data
Automatically parses Applied Photophysics Circular Dichroism Spectrometer ouput and plots data in origin.
Fitting optical spectroscopy data with complex Drude or Lorentzians.
Broadband microwave spectroscopy analysis code
Management of spectroscopic data.
I developed these codes and models to process remote sensing data and partition the data into clusters and classes. These models were developed to facilitate the processing of field data.
Chondro data set for use with hyperSpec
A python package for handling JWST observations
A parser for the SPC file format
testing denoising schemes in python
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