Mercurial > repos > metaboflow_cam > masspix

diff masspix/libraries/lib_modification.csv @ 2:b2f4fc0fc97d draft default tip

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author metaboflow_cam
date Tue, 22 Oct 2019 05:44:45 -0400
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/masspix/libraries/lib_modification.csv	Tue Oct 22 05:44:45 2019 -0400
@@ -0,0 +1,12 @@
+name,type,class,mass
+choline,NL,insource,-59.073499
+phosphocholine,NL,insource,-183.066047
+PE-C2H5N,NL,insource,-43.042199
+phosphoethanolamine,NL,insource,-141.019097
+water,NL,insource,-18.010565
+C13palmitate,label,stableisotope,16.05368
+oxidised,oxidised,biomod,15.994915
+desat.1,desat,biomod,-2.01565
+desat.2,desat,biomod,-4.0313
+desat.3,desat,biomod,-6.04695
+desat.4,desat,biomod,-8.0626