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Examination of distribution of trace elements in hair, fingernails and toenails as alternative biological materials. Application of chemometric methods

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Przybylowicz A., Chesy P., Herman M., Parczewski A., Walas S., Piekoszewski W.
Open Chemistry
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2012
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vol. 10
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issue 5
1590-1599
EN
The aim of this study was to find correlations between several studied elements and analyzed materials as well as the application and validation of an analytical method to determine trace elements in hair, fingernails and toenails of healthy volunteers (normal concentration). The method developed covers washing, mineralization and ICP-MS determination of 10 elements (Ca, Cd, Co, Cr, Cu, Fe, Mg, Ni, Pb and Zn) in hair and nails. Concentrations of the selected elements in hair, fingernails and toenails were measured for 24 women and 18 men. Furthermore, a chemometric approach (Principal Component Analysis, PCA) was employed to evaluate the correlations between concentrations of the elements in hair and nails and between these materials. Until now PCA has not been frequently applied in handling and interpretation of the results of analysis of biological materials. However, the results of the present investigation show the high potential of PCA in extraction of valuable information from analytical measurements. Additionally, PCA has become a useful tool for visualization of the obtained results. Moreover, the cluster analysis (CA) was used to group the samples according to gender, taking into account two different groups of elements: essential and toxic. [...]
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Metoda 4M – nowe zastosowanie spektroskopii mössbauerowskiej w klasyfikacji zrównoważonych chondrytów zwyczajnych

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Woźniak M., Karwowski Ł., Gałązka-Friedman J., Duda P., Jakubowska M., Bogusz P.
Acta Societatis Metheoriticae Polonorum
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2020
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vol. 11
125-140
EN
The 4M method aims to determine the type of equilibrated ordinary chondrite only on the basis of the Mössbauer spectrum of the investigated meteorite. Mössbauer spectrum of non-weathered ordinary chondrite is comprised of four sub-spectra: two doublets and two sextets. One of the doublets consists of a signal from iron present in olivine and the other consists of a signal from iron present in pyroxene. Sextets on the other hand, contain signals from magnetically ordered iron. One sextet is related to the metallic phase (kamacite, taenite), whereas the second is related to troilite. A third of doublets, which emerges in weathered ordinary chondrites, is related to products of the oxidation of iron present in metallic phase. The spectral areas of olivine, pyroxenes, metallic phase and troilite, which were obtained from Mössbauer spectrum are proportional to the number of iron atoms present in relevant mineral phases. Some Mössbauer groups were inspired by this fact to construct different methods to determine the type (H, L, or LL) of investigated meteorites (Gałązka-Friedman et al. 2019, Hyp. Inter. 241(1)). However, these methods, based on subjective criteria, were only qualitative. Our group elaborated a quantitative method, which is based on objective criteria. We called it the "4M method" (where M are derived from meteorites, Mössbauer spectroscopy, multidimensional discriminant analysis (MDA), Mahalanobis distance) (Woźniak et al. 2019). This method was using only the Mössbauer experimental data, to which it applied advanced statistical methods. The base, which was created from Mössbauer data, consisted of three clusters H, L, LL. These clusters were constructed with sets of 4-dimensional vectors. The vectors are comprised of spectral areas of Mössbauer spectrum: ol (value proportional to iron present in olivine), pyr (value proportional to iron present in pyroxene), met (value proportional to iron present in metallic phase), tr (value proportional to iron present in troilite). To determine the type of investigated ordinary chondrite, its ol, pyr, met and tr values with average values of variables obtained for clusters H, L and LL need to be compared. The comparison can be performed with the use of MDA and Mahalanobis distance. Once Mahalanobis distance of the investigated meteoriteis is known, the level of similarity to three types of ordinary chondrites can be calculated. Examples of such calculations were performed for seven ordinary chondrites: Goronyo, Carancas, New Concord, NWA 7733, Leoncin, Sołtmany and Pułtusk. They were made with the use of the new base composed of 62 non-weathered ordinary chondrites. All results obtained with the 4M method yielded results consistent with traditional mineralogical methods.
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