Description Usage Arguments Details Value Author(s) Examples
Convert msp data frame into object of
msp is a data frame of a .MSP file, a typical data file for
MS/MS libraries. The data frame has two columns and contains in the first
column the entries "NAME:",
"PRECURSORMZ:" (or "EXACTMASS:"), "Num Peaks:" and information on fragments and
peak areas/intensities. It may additionally contain row entries:
convertMSP2MSP will try to find the row entries "RETENTIONTIME:",
"ADDUCTIONNAME:" (or "PRECURSORTYPE:"), "CLASS:" and "INFORMATION:" and
extract the respective information in the second column.
convertMSP2MSP returns an object of class
Thomas Naake, firstname.lastname@example.org
data("convertMSP2MSP", package = "MetCirc") convertMSP2MSP(msp = msp2msp)
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