Description Usage Arguments Author(s) References Examples
Generates a given a library of MS1 metabolites, a list of adducts and isotopes. Adapted from R package OrgMassSpecR.
1 |
library |
Library of MS1 metabolites. |
name |
Name of the adduct to generate. |
adducts |
List of adducts. |
Manuel D Peris Diaz
1. R-MetaboList: a flexible tool for metabolite extraction from high-resolution data-independent acquisition mass spectrometry analysis. Metabolites. Soon
2. A Survey of Orbitrap All Ion Fragmentation Analysis Assessed by an R MetaboList Package to Study Small-Molecule Metabolites. Chromatographia. 2018, 81, 981-994.
1 2 3 | #library(MetaboList)
#Reading the library and indicating type of adduct
#Isotopic(library,name=c("M+H"))
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