From d029d5d7f8ead1f1de8d318045004a4a6f68f5fb Mon Sep 17 00:00:00 2001 From: Bonface Date: Fri, 9 Feb 2024 09:41:28 -0600 Subject: Update dataset RTF Files. --- general/datasets/RTI_RCMRC_BXDFecMetLFlog0814/notes.rtf | 5 +++++ 1 file changed, 5 insertions(+) create mode 100644 general/datasets/RTI_RCMRC_BXDFecMetLFlog0814/notes.rtf (limited to 'general/datasets/RTI_RCMRC_BXDFecMetLFlog0814/notes.rtf') diff --git a/general/datasets/RTI_RCMRC_BXDFecMetLFlog0814/notes.rtf b/general/datasets/RTI_RCMRC_BXDFecMetLFlog0814/notes.rtf new file mode 100644 index 0000000..8da96fa --- /dev/null +++ b/general/datasets/RTI_RCMRC_BXDFecMetLFlog0814/notes.rtf @@ -0,0 +1,5 @@ +

For symbols of metabolites if the differences were greater than .0003 proportional m/z units (m/z difference divided by m/z value) then the symbol was labeled "circa" after the atomic composition. 

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For description of metabolites if the proportional difference of the m/z ratio between Evan's EPFL Polar metabolite assignments and RTI assignments was very low (<.0001 proportional m/z units) then the symbol and description was taken directly from Evan's metabolite file, but if differences were between 0.0001 and about .0003 proportional m/z units then the descriptions were labeled "Putative" . If the differences were greater than .0003 units, then the descriptions were labeled "Provisional". For example, "Provisional assignment. Vanilpyruvic acid is a catecholamine metabolite and precursor to vanilactic acid. Accumulation in urine is indicative of Aromatic L-aminoacid decarboxylase deficiency (PMID 16288991)." 

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 by Rob Williams and Arthur Centeno, Aug 25, 2014

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