Package: mrbin
Title: Metabolomics Data Analysis Functions
Version: 1.9.5
Authors@R: 
    person(given = "Matthias",
           family = "Klein",
           role = c("aut", "cre"),
           email = "matthias.s.klein@gmx.net",
           comment = c(ORCID = "0000-0001-7455-5381"))
Description: A collection of functions for processing and analyzing metabolite data. 
    The namesake function mrbin() converts 1D 
    or 2D Nuclear Magnetic Resonance data into a matrix of values suitable for further data analysis and
    performs basic processing steps in a reproducible way. Negative values, a
    common issue in such data, can be replaced by positive values (<doi:10.1021/acs.jproteome.0c00684>). All used
    parameters are stored in a readable text file and can be restored from that
    file to enable exact reproduction of the data at a later time. The function fia() ranks features according
    to their impact on classifier models, especially artificial neural network models.
Imports: grDevices, graphics, stats, utils, methods, Matrix
Depends: R (>= 2.10)
License: GPL-3
Encoding: UTF-8
RoxygenNote: 7.3.3
Suggests: parallel, keras
VignetteBuilder: utils
URL: https://github.com/kleinomicslab/mrbin
NeedsCompilation: no
Packaged: 2026-02-27 13:48:26 UTC; Matthias
Author: Matthias Klein [aut, cre] (ORCID:
    <https://orcid.org/0000-0001-7455-5381>)
Maintainer: Matthias Klein <matthias.s.klein@gmx.net>
Repository: CRAN
Date/Publication: 2026-02-27 14:20:07 UTC
Built: R 4.5.3; ; 2026-06-04 19:23:17 UTC; windows
