binneR

Spectral Processing for High Resolution Flow Infusion Mass Spectrometry

A spectral binning approach for flow infusion electrospray high resolution mass spectrometry (FIE-HRMS) data. Includes tools for generating intensity matrices converted raw data file formats such as .mzML and .mzXML, plotting chromatograms and total ion counts.

Installation

Download and install from CRAN, run the following in an R console:

install.packages('binneR')

The CRAN version can be found on the cran branch of this repository.

The example data used in this package are from the metaboData package that can be installed using:

remotes::install_github('jasenfinch/metaboData')

To download and install this development vesion run:

remotes::install_github('jasenfinch/binneR',build_opts =c("--no-resave-data", "--no-manual"))

Vignette

The vignette outlining the package usage and features can be found using:

vignette('binneR',package = 'binneR')