Calculation of metabolite concentrations from C12 and C13 Mass Spectrometry Integrated Data
Project description
IDQuant (Isotopic Dilution Quantification) is a software that calculates sample concentrations of metabolites from C12 and C13 Mass Spectrometry Integrated Data
It uses linear and quadratic regression equations to predict concentrations using calibration data from (unlabeled and fully labeled) Standard Molecules. It takes as input integrated C12/C13 MS data from Emzed C13 Profiler.
It is one of the routine tools used by MetaToul platform.
The code is open-source, and available on GitHub under a GPLv3 license.
The documentation relative to the usage of IDQuant can be found on it’s ReadTheDocs page.
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