profile_model_spectrum: Automatic quantification in the model spectrum of the dataset...

In danielcanueto/rDolphin: Reliable automatic profiling of 1D 1H NMR Spectra, with additional tools for analysis

Description

Automatic quantification in the model spectrum of the dataset using the information located in the ROI patterns file, with associated p values for every bin. The reulting information can be useful to analyze possible new ROIs to profile or modification of existing ones.

Usage

profile_model_spectrum(imported_data, ROI_data, spectrum_index = NA)

Arguments

imported_data	List with typical elements necessary to perform quantification of ROIs.
ROI_data	ROI data to check.
spectrum_index	By default, NA and a spectrum model is calculated. If specified, the profiling in the spectrum specified is performed.

Value

plotly figure with performed fitting for every ROI and p value for every bin

Examples

setwd(paste(system.file(package = "rDolphin"),"extdata",sep='/'))
imported_data=import_data("Parameters_MTBLS242_15spectra_5groups.csv")
model_spectrum_plot=profile_model_spectrum(imported_data,imported_data$ROI_data)

danielcanueto/rDolphin documentation built on May 14, 2019, 4:03 p.m.