make.spectra.lib: Create a predicted spectral library

In MarcIsak/MSLibrarian: What the Package Does (One Line, Title Case)

Create a predicted spectral library

Description

Create a predicted spectral library

Usage

make.spectra.lib(msLib, bestCe, predDb, ceMode)

Arguments

msLib	input MSLibrarian object
bestCe	absolute path to a RData object containing optimal collision energies for MS/MS predictions.
predDb	character giving the absolute location of the prediction database.
ceMode	character specifying the mode for collision energy optimization. Available modes are c("length_only", "length_charge", "charge", scalar)

MarcIsak/MSLibrarian documentation built on Aug. 27, 2022, 4:55 a.m.