importGMD: Import MSP files from GMD to R

In erah: Automated Spectral Deconvolution, Alignment, and Metabolite Identification in GC/MS-Based Untargeted Metabolomics

Description

Import the Golm Metabolome Database.

Usage

importGMD(filename, DB.name, DB.version, DB.info, 
type=c("VAR5.ALK","VAR5.FAME","MDN35.ALK", "MDN35.FAME"))

Arguments

filename	The filepath containing the GMD database file.
DB.name	The name of the database (each user may chose its own name)
DB.version	The version of the database (each user may chose its own version)
DB.info	Some info about the database for further reference
type	The type of RI to be imported from the database

Details

For more details, please see the eRah manual

erah documentation built on May 11, 2021, 9:11 a.m.