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NMR data simulation software tools | NMR-based metabolomics analysis

A major technique for capturing metabolite data is 1H-NMR spectroscopy and this yields highly complex profiles that require sophisticated statistical analysis methods. However, experimental data is difficult to control and expensive to obtain. Thus data simulation is a productive route to aid algorithm development.

Source text:
(Muncey., 2010) MetAssimulo: simulation of realistic NMR metabolic profiles. BMC Bioinformatics.

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