MMM_solve_QP {SOMnmR}

Linear combination fitting solve function

Description

Quadratic programming solution function for linear combination fitting (LCF)

Usage

MMM_solve_QP(LCF.stds, LCF.samp, NMRmeth = NULL, FixNC)

Arguments

LCF.stds

Standards for LCF

LCF.samp

NMR Sample(s) for LCF

NMRmeth

Regions to be integrated, methods available include: "4region", "Bonanomi", "Smernik" and Molecular mixing model ("MMM").

FixNC

TRUE or FALSE, for fixing or not the NC ratio on the sample fitting.

Value

A dataframe containing the result of the quadratic programming exercise, constrained or not by the Nc ratio (FixNC)