Hi All,
I am using xcms + camera for metabolomics analysis. After get the "annotated diffreport" file from camera, what should I do next for the database search? How to consider the "isotope" and "adducts" columns that generated by CAMERA?
Thanks
Hi,
one idea would be to ignore all higher isotopes, and "subtract" the mass of the adduct
from the m/z. You could use the Rdisop subMolecule() for that.
Yours,
Steffen