MMM_solve_QP

Quadratic programming solution function for linear combination fitting (LCF)

Normalization

correction

Integrates the 13C nuclear magnetic resonance spectra using different integration ranges. Output depends on the method chosen. For the Molecular Mixing Model, a measurement of the fitting quality is given by its R-factor. For more details see: <doi:10.5281/zenodo.10137768>.

Luis Colocho

SOMnmR

Analysis of Soil Organic Matter using Nuclear Magnetic Resonance

MMM_solve_QP function

<dl><dt>LCF.stds</dt>
<dd>Standards for LCF</dd>
<dt>LCF.samp</dt>
<dd>NMR Sample(s) for LCF</dd>
<dt>NMRmeth</dt>
<dd>Regions to be integrated, methods available include: "4region", "Bonanomi", "Smernik" and Molecular mixing model ("MMM").</dd>
<dt>FixNC</dt>
<dd>TRUE or FALSE, for fixing or not the NC ratio on the sample fitting.</dd></dl>

Arguments

Linear combination fitting solve function — MMM_solve_QP

<dl>

<dt>LCF.stds</dt>
<dd>Standards for LCF</dd>


<dt>LCF.samp</dt>
<dd>NMR Sample(s) for LCF</dd>


<dt>NMRmeth</dt>
<dd>Regions to be integrated, methods available include: "4region", "Bonanomi", "Smernik" and Molecular mixing model ("MMM").</dd>


<dt>FixNC</dt>
<dd>TRUE or FALSE, for fixing or not the NC ratio on the sample fitting.</dd>

</dl>

MMM_solve_QP: Linear combination fitting solve function

Description

Usage

Value

Arguments