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DESCRIPTION
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DESCRIPTION
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Package: nmrrr
Type: Package
Title: Binning and Visualizing NMR Spectra in Environmental Samples
Version: 1.0.0
Authors@R:
c(person("Kaizad", "Patel",
email = "kaizad.patel@pnnl.gov",
role = c("aut", "cre"),
comment = c(ORCID = "0000-0001-6437-7809")),
person("Allison", "Myers-Pigg",
email = "allison.myers-pigg@pnnl.gov",
role = c("aut"),
comment = c(ORCID = "0000-0002-6905-6841")),
person("Ben", "Bond-Lamberty",
email = "bondlamberty@pnnl.gov",
role = c("ctb"),
comment = c(ORCID = "0000-0001-9525-4633")),
person("Morgan", "Barnes",
email = "morgan.barnes@pnnl.gov",
role = c("ctb"),
comment = c(ORCID = "0000-0001-8722-6552")))
Description: 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.
URL: https://github.com/kaizadp/nmrrr
BugReports: https://github.com/kaizadp/nmrrr/issues
License: MIT + file LICENSE
Copyright: Battelle Memorial Institute
Encoding: UTF-8
RoxygenNote: 7.2.3
Imports:
DescTools,
ggplot2,
tidyr,
utils
Suggests:
covr,
knitr,
rmarkdown,
testthat (>= 3.0.0),
tibble
Config/testthat/edition: 3
Depends:
R (>= 3.50)
LazyData: true
VignetteBuilder: knitr