Untargeted metabolomics, also called discovery metabolomics, usually involves the comparison of the metabolome between the control and test groups, to identify differences between their metabolite profiles which may be relevant to specific biological conditions.
There are usually three steps in the experimental workflow:
|1||Profiling in order to seek the metabolites with statistically significant variations in abundance within a set of experimental and control samples;|
|2||Determination of metabolite ID, including the chemical structure;|
|3||Comprehensions as the last step which makes connections between the identified metabolites and the biological processes.|
In the workflow of discovery metabolomics, analytical reproducibility is critical for ex
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