## ----options, include = FALSE------------------------------------------------- knitr::opts_chunk$set( collapse = TRUE, comment = "#>" ) ## ----load_package, eval=TRUE, message=FALSE, warning=FALSE-------------------- library(MetaboAnnotatoR) ## ----filepath, eval=TRUE------------------------------------------------------ msp_path <- system.file("extdata", "MassBank_example.msp", package="MetaboAnnotatoR") ## ----setwd_to_run, eval=TRUE-------------------------------------------------- LibDir <- tempdir() ## ----run_function, eval=TRUE, warning=FALSE----------------------------------- mspToLib(msp_path, LibDir, noise=0.005, mpeaksScore=0.9, mpeaksThres=0.1) ## ----sessionInfo-------------------------------------------------------------- sessionInfo()