| Literature DB >> 26893081 |
Azadeh Golshan1, Hamid Abdollahi2, Samira Beyramysoltan3, Marcel Maeder4, Klaus Neymeyr5, Robert Rajkó6, Mathias Sawall7, Romá Tauler8.
Abstract
Soft modelling or multivariate curve resolution (MCR) are well-known methodologies for the analysis of multivariate data in many different application fields. Results obtained by soft modelling methods are very likely impaired by rotational and scaling ambiguities, i.e. a full range of feasible solutions can describe the data equally well while fulfilling the constraints of the system. These issues are severely limiting the applicability of these methods and therefore, they can be considered as the most challenging ones. The purpose of the current review is to describe and critically compare the available methods that attempt at determining the range of ambiguity for the case of 3-component systems. Theoretical and practical aspects are discussed, based on a collection of simulated examples containing noise-free and noisy data sets as well as an experimental example.Keywords: Band boundaries of feasible solutions; Rotational ambiguity; Soft modelling; Unique solutions
Year: 2016 PMID: 26893081 DOI: 10.1016/j.aca.2016.01.011
Source DB: PubMed Journal: Anal Chim Acta ISSN: 0003-2670 Impact factor: 6.558