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  • Exploring the potential of ...
    Petrov, Oleg V.; Lang, Jan; Vogel, Michael

    Journal of magnetic resonance (1997), 20/May , Letnik: 326
    Journal Article

    Display omitted •PCA-based quantitation of T1 relaxation data outperforms integration in general.•The actual benefit of using PCA depends on the signal shape and quantitation domain.•PCA-based quantitation in the time domain can be performed on full-length FIDs.•Data correction for frequency or phase variations, if any, is a prerequisite for PCA. Principal component analysis (PCA) has proved to be a powerful technique for processing NMR data. It is particularly useful in signal quantitation where it often provides better results compared to a direct integration of individual signals. In the present work, we recapitulate the principles and theoretical framework underlying PCA-based quantitation with a special focus on T1 relaxometry. We show that under commonly encountered conditions, this approach can provide up to ~4-fold improvement in scatter of points in magnetization build-up curves compared to direct integration. Best practices to optimize the PCA performance in measuring the total magnetization are discussed, including minimization of the number of signal-related principal components and a proper selection of FT parameters and data quantitation intervals. For signals consisting of distinct relaxation components, formulas are provided for resolving the components relaxation and illustrated on a real-data example. In addition to the problem of quantitation, the use of PCA in denoising of partially relaxed spectra is discussed in connection with such applications as line shape analysis and monitoring relaxation of individual spectral components.