Louis-Félix Nothias
Louis-Félix Nothias
Hi tmap @reymond-group, @daenuprobst @undeadpixel, and community First of all ! It is a great tool, so congratulations for your work and manuscript, and thanks a lot for your effort...
This is an excellent ontology for chemical compound. https://jcheminf.springeropen.com/articles/10.1186/s13321-016-0174-y It can be downloaded as OBO. http://classyfire.wishartlab.com/downloads Can you add it EBI ontology look up service ? Thanks, LF
Example Data to works with: FBMN: https://gnps.ucsd.edu/ProteoSAFe/status.jsp?task=37249ef47b3d46b1a922f3adedb9583b Sirius: https://proteomics2.ucsd.edu/ProteoSAFe/status.jsp?task=4ac845c950b4455f8c6435bf8dfc7e7a
More informations on the processing with MZmine. More informations on support of MGF from other tools.
There is a built-in function and an app for that.