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DOI 10.3390/life16071054

Медицинская библиотека · Life (Basel, Switzerland) · 2026

Day-Zero Serum FTIR Spectroscopy Identifies a Biochemical Signature Associated with Functional Pancreas Graft Dysfunction After Simultaneous Pancreas-Kidney Transplantation.

Vigia Emanuel, Ramalhete Luís, Araújo Rúben, Corado Sofia, Barros Inês, Chumbinho Beatriz, Nobre Ana, Carrelha Sofia, Pico Paula, Rodrigues Fernando, Bigotte Miguel, Magriço Rita, Cotovio Patrícia, Caeiro Fernando, Aires Inês, Silva Cecília, Pena Ana, Bicho Luís, Jorge Cristina, Calado Cecília R C, Pereira Jorge P, Ferreira Aníbal, Marques Hugo P

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Аннотация

BACKGROUND

Simultaneous pancreas-kidney (SPK) transplantation can restore renal function and insulin independence, but non-technical pancreas graft dysfunction remains difficult to anticipate.

METHODS

We conducted an exploratory single-centre retrospective biomarker-modelling study to determine whether day-zero recipient serum Fourier-transform infrared (FTIR) spectra are associated with subsequent loss of insulin independence after SPK transplantation.

RESULTS

Among 104 screened recipients, 51 met predefined sample-availability, spectral-quality, data-linkage and endpoint-adjudication criteria; 30 maintained pancreas graft function and 21 developed dysfunction. Cases dominated by early technical surgical failure were excluded. Clinical-only, FTIR-only and FTIR-clinical Naïve Bayes models were evaluated using leave-one-out cross-validation with Fast Correlation-Based Filter feature selection. In locked-feature internal validation, the best FTIR-only model used second-derivative spectra with vector normalization and nine selected wavenumbers, achieving AUC 0.997 (95% CI 0.985-1.000) and accuracy 0.961 (95% CI 0.902-1.000). A fixed-feature permutation analysis exceeded label-randomized performance (empirical p = 0.001). The secondary Group 1 versus Group 3 analysis suggested discrimination of pancreas dysfunction despite preserved kidney function (AUC 0.992; accuracy 0.930).

CONCLUSIONS

Given the small cohort, high-dimensional input, non-nested feature selection, selection-bias risk and absence of external validation, serum FTIR should be considered a candidate risk-enrichment platform requiring prospective multicentre validation.

Для цитирования: Vigia Emanuel, Ramalhete Luís, Araújo Rúben, Corado Sofia, Barros Inês, Chumbinho Beatriz, Nobre Ana, Carrelha Sofia, Pico Paula, Rodrigues Fernando, Bigotte Miguel, Magriço Rita, Cotovio Patrícia, Caeiro Fernando, Aires Inês, Silva Cecília, Pena Ana, Bicho Luís, Jorge Cristina, Calado Cecília R C, Pereira Jorge P, Ferreira Aníbal, Marques Hugo P. Day-Zero Serum FTIR Spectroscopy Identifies a Biochemical Signature Associated with Functional Pancreas Graft Dysfunction After Simultaneous Pancreas-Kidney Transplantation.. Life (Basel, Switzerland). 2026. DOI: 10.3390/life16071054.
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