nmrrr: Binning and Visualizing NMR Spectra in Environmental Samples

A reproducible workflow for binning and visualizing NMR (nuclear magnetic resonance) spectra from environmental samples. The 'nmrrr' package is intended for post-processing of NMR data, including importing, merging and, cleaning data from multiple files, visualizing NMR spectra, performing binning/integrations for compound classes, and relative abundance calculations. This package can be easily inserted into existing analysis workflows by users to help with analyzing and interpreting NMR data.

Package details

AuthorKaizad Patel [aut, cre] (<https://orcid.org/0000-0001-6437-7809>), Allison Myers-Pigg [aut] (<https://orcid.org/0000-0002-6905-6841>), Ben Bond-Lamberty [ctb] (<https://orcid.org/0000-0001-9525-4633>), Morgan Barnes [ctb] (<https://orcid.org/0000-0001-8722-6552>)
MaintainerKaizad Patel <kaizad.patel@pnnl.gov>
LicenseMIT + file LICENSE
Version1.0.0
URL https://github.com/kaizadp/nmrrr
Package repositoryView on CRAN
Installation Install the latest version of this package by entering the following in R:
install.packages("nmrrr")

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nmrrr documentation built on May 31, 2023, 6:35 p.m.