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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 |
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| Author | Kaizad 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>) |
| Maintainer | Kaizad Patel <kaizad.patel@pnnl.gov> |
| License | MIT + file LICENSE |
| Version | 1.0.0 |
| URL | https://github.com/kaizadp/nmrrr |
| Package repository | View on CRAN |
| Installation |
Install the latest version of this package by entering the following in R:
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