Mercurial > repos > marie-tremblay-metatoul > 2dnmrannotation
diff test-data/2DNMRAnnotation_duplicateHMBC.tabular @ 3:546c7ccd2ed4 draft default tip
"planemo upload for repository https://github.com/workflow4metabolomics/tools-metabolomics commit 911f4beba3dcb25c1033e8239426f8f763683523"
| author | workflow4metabolomics |
|---|---|
| date | Fri, 04 Feb 2022 09:01:11 +0000 |
| parents | |
| children |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/test-data/2DNMRAnnotation_duplicateHMBC.tabular Fri Feb 04 09:01:11 2022 +0000 @@ -0,0 +1,20 @@ +ppm1 ppm2 commonMetabolitesList +0.9975 31.8443 L-valine Taurocholic acid +3.658 74.853 Glycerol D-Mannose D-Galactose +3.5453 75.5793 D-Glucose Myo-Inositol +3.7256 72.2932 D-Glucose D-Galactose L-ascorbic acid +3.7214 73.9362 D-Glucose maltose +3.8341 71.9646 D-Glucose Sucrose Raffinose +0.9431 27.3862 Isoleucine 4-methyl-2-oxopentanoic acid +3.6795 177.2002 Isoleucine Phenylacetylglycine Phenylacetyl-L-glutamine +1.7317 41.9356 Cadaverine L-lysine +1.7224 25.1451 Cadaverine L-leucine +3.0227 25.6132 Cadaverine 5-aminopentanoic acid +3.0227 29.096 Cadaverine L-lysine 5-aminopentanoic acid +4.0162 176.6782 L-Histidine L-asparagine +4.0138 176.324 L-asparagine L-Histidine L-Phenylalanine +4.0724 29.0374 L-Tryptophan Cholic acid +7.2025 114.7667 L-Tryptophan indoxyl sulfate +2.147 56.9062 L-glutamine Glutamic acid L-methionine +2.1472 176.985 L-glutamine Glutamic acid L-methionine +3.7825 177.069 L-glutamine L-Arginine