IRgritter

IRgritter is a software tool designed for the analysis and visualization of infrared (IR) spectral data. It is developed to assist researchers and scientists in fields such as chemistry, materials science, and environmental monitoring who utilize IR spectroscopy for identifying and characterizing substances. The software provides a range of functionalities for processing raw IR spectra, including baseline correction, smoothing, and normalization.

A key feature of IRgritter is its capability to perform spectral matching against curated databases. Users can input an unknown spectrum and compare it against a library of known spectra to identify potential compounds or materials. The tool offers various algorithms for spectral comparison, allowing for flexible and robust identification. Additionally, IRgritter includes tools for spectral deconvolution and peak analysis, which help in resolving complex spectral features and extracting quantitative information.

The visualization component of IRgritter enables users to display spectra in interactive plots. This allows for easy comparison of multiple spectra, examination of peak positions and intensities, and assessment of spectral changes over time or under different conditions. The software aims to streamline the workflow of IR spectral analysis, making it more accessible and efficient for a wider range of users. It is typically used in academic research laboratories and industrial R&D settings.