An Integrated Statistical and Machine Learning Framework for Thermo-Mechanical Optimization of Amaranth–Lupin Composite Doughs
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The optimization of composite flour formulations requires analytical approaches capable of integrating multiple interdependent rheological attributes. This study aimed to evaluate the thermo-mechanical behavior of doughs formulated through the progressive substitution of amaranth flour with lupin flour (0–40%). Rheological parameters were determined using Mixolab, considering consistency, protein weakening, gelatinization, thermal stability, and retrogradation. The analysis was conducted using an integrated approach combining univariate statistics, multivariate analysis, and machine learning. The results revealed significant differences among treatments, with large effect sizes in initial consistency and retrogradation, indicating a strong influence of formulation on the structural behavior of the dough. Multivariate analysis identified distinct patterns and explained a high proportion of the total system variability, while machine learning confirmed discrimination between formulations and the stability of the performance ranking. Overall, the integrated approach enhances decision-making reliability and provides a robust strategy for optimizing composite doughs in complex food systems.
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Adin, A., Krainski, E. T., Lenzi, A., Liu, Z., Martínez-Minaya, J., & Rue, H. (2024). Automatic cross-validation in structured models: Is it time to leave out leave-one-out? Spatial Statistics, 62, Artículo 100843. https://doi.org/10.1016/j.spasta.2024.100843 DOI: https://doi.org/10.1016/j.spasta.2024.100843
Araújo, S. O., Peres, R. S., Ramalho, J. C., Lidon, F., & Barata, J. (2023). Machine learning applications in agriculture: Current trends, challenges, and future perspectives. Agronomy, 13(12), Artículo 2976. https://doi.org/10.3390/agronomy13122976 DOI: https://doi.org/10.3390/agronomy13122976
Atudorei, D., Atudorei, O., & Codină, G. G. (2021). Dough rheological properties, microstructure and bread quality of wheat-germinated bean composite flour. Foods, 10(7), Artículo 1542. https://doi.org/10.3390/foods10071542 DOI: https://doi.org/10.3390/foods10071542
Bansal, S., Rodriguez, C. Z., Thompson-Witrick, K. A., Wang, Y., Taft, D. H., & Zhang, B. (2025). Machine learning-powered multi-omics for food microbiology and smarter food safety. Trends in Food Science & Technology, 163, Artículo 105145. https://doi.org/10.1016/j.tifs.2025.105145 DOI: https://doi.org/10.1016/j.tifs.2025.105145
Benjamini, Y., Drai, D., Elmer, G., Kafkafi, N., & Golani, I. (2001). Controlling the false discovery rate in behavior genetics research. Behavioural Brain Research, 125(1–2), 279–284. https://doi.org/10.1016/S0166-4328(01)00297-2 DOI: https://doi.org/10.1016/S0166-4328(01)00297-2
Benkadri, S., Salvador, A., Sanz, T., & Zidoune, M. N. (2021). Optimization of xanthan and locust bean gum in a gluten-free infant biscuit based on rice-chickpea flour using response surface methodology. Foods, 10(1), Artículo 12. https://doi.org/10.3390/foods10010012 DOI: https://doi.org/10.3390/foods10010012
Breiman, L. (2001). Random forests. Machine Learning, 45(1), 5–32. https://doi.org/10.1023/A:1010933404324 DOI: https://doi.org/10.1023/A:1010933404324
Chopin Technologies. (2012). Mixolab applications handbook: Rheological and enzyme analyses, analysis methods, studies and applications.
Chuqui-Paulino, F. J., Hidalgo Chávez, D. W., Ramírez Ascheri, J. L., Grassi Mellinger, C., Vargas-Solorzano, J. W., & Carvalho, C. W. P. (2025). Impact of whole cereal–pulse flours on the functionality and antioxidant properties of gluten-free extruded flours. Foods, 14(20), Artículo 3515. https://doi.org/10.3390/foods14203515 DOI: https://doi.org/10.3390/foods14203515
Codină, G. G., Mironeasa, S., Mironeasa, C., Popa, C. N., & Tamba-Berehoiu, R. (2012). Wheat flour dough Alveograph characteristics predicted by Mixolab regression models. Journal of the Science of Food and Agriculture, 92(3), 638–644. https://doi.org/10.1002/jsfa.4623 DOI: https://doi.org/10.1002/jsfa.4623
Dubat, A. (2010). A new AACC International approved method to measure rheological properties of a dough sample. Cereal Foods World, 55(3), 150–153. https://doi.org/10.1094/CFW-55-3-0150 DOI: https://doi.org/10.1094/CFW-55-3-0150
Duodu, K. G., & Minnaar, A. (2011). Legume composite flours and baked goods: Nutritional, functional, sensory, and phytochemical qualities. En V. R. Preedy, R. R. Watson, & V. B. Patel (Eds.), Flour and breads and their fortification in health and disease prevention (pp. 193–203). Academic Press. https://doi.org/10.1016/B978-0-12-380886-8.10018-2 DOI: https://doi.org/10.1016/B978-0-12-380886-8.10018-2
Dvořáček, V., Bradová, J., Sedláček, T., & Šárka, E. (2019). Relationships among Mixolab rheological properties of isolated starch and white flour and quality of baking products using different wheat cultivars. Journal of Cereal Science, 89, Artículo 102801. https://doi.org/10.1016/j.jcs.2019.102801 DOI: https://doi.org/10.1016/j.jcs.2019.102801
Efron, B., & Tibshirani, R. J. (1993). An introduction to the bootstrap. Chapman & Hall/CRC. https://doi.org/10.1201/9780429246593 DOI: https://doi.org/10.1007/978-1-4899-4541-9
Galarza-Sánchez, P. C., Erazo-Luzuriaga, A. F., & Boné-Andrade, M. F. (2023). Uso de computación cuántica en la mejora de algoritmos de aprendizaje automático. Revista Científica Ciencia Y Método, 1(4), 16-30. https://doi.org/10.55813/gaea/rcym/v1/n4/25 DOI: https://doi.org/10.55813/gaea/rcym/v1/n4/25
Granato, D., Santos, J. S., Escher, G. B., Ferreira, B. L., & Maggio, R. M. (2018). Use of principal component analysis (PCA) and hierarchical cluster analysis (HCA) for multivariate association between bioactive compounds and functional properties in foods: A critical perspective. Trends in Food Science & Technology, 72, 83–90. https://doi.org/10.1016/j.tifs.2017.12.006 DOI: https://doi.org/10.1016/j.tifs.2017.12.006
Hadnađev, T. D., Torbica, A., & Hadnađev, M. (2011). Rheological properties of wheat flour substitutes/alternative crops assessed by Mixolab. Procedia Food Science, 1, 328–334. https://doi.org/10.1016/J.PROFOO.2011.09.051 DOI: https://doi.org/10.1016/j.profoo.2011.09.051
Jolliffe, I. T., & Cadima, J. (2016). Principal component analysis: A review and recent developments. Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, 374(2065), Artículo 20150202. https://doi.org/10.1098/rsta.2015.0202 DOI: https://doi.org/10.1098/rsta.2015.0202
Kharbach, M. (2025). AI-Powered Advances in Data Handling for Enhanced Food Analysis: From Chemometrics to Machine Learning. Foods 2025, Vol. 14, Page 3415, 14(19), 3415. https://doi.org/10.3390/FOODS14193415 DOI: https://doi.org/10.3390/foods14193415
Li, M., Zhang, Y., You, X., Wang, Y., Zhou, K., Wei, P., & Wei, L. (2023). Assessment of functional properties of wheat–cassava composite flour. Foods, 12(19), Artículo 3585. https://doi.org/10.3390/foods12193585 DOI: https://doi.org/10.3390/foods12193585
Meneses Quelal, O., & Pulles, M. B. (2025). Nutritional, functional and microbiological potential of Andean Lupinus mutabilis and Amaranthus spp. in the development of healthy foods—a review. Foods, 14(12), Artículo 2059. https://doi.org/10.3390/foods14122059 DOI: https://doi.org/10.3390/foods14122059
Meng, K., Gao, H., Zeng, J., Zhao, J., Qin, Y., Li, G., & Su, T. (2021). Rheological and microstructural characterization of wheat dough formulated with konjac glucomannan. Journal of the Science of Food and Agriculture, 101(10), 4373–4379. https://doi.org/10.1002/jsfa.11078 DOI: https://doi.org/10.1002/jsfa.11078
Mougan, C., & Nielsen, D. S. (2023). Monitoring model deterioration with explainable uncertainty estimation via non-parametric bootstrap. Proceedings of the AAAI Conference on Artificial Intelligence, 37(12), 15037–15045. https://doi.org/10.1609/aaai.v37i12.26755 DOI: https://doi.org/10.1609/aaai.v37i12.26755
Rico, D., González-Paramás, A. M., Brezmes, C., & Martín-Diana, A. B. (2020). Baking optimization as a strategy to extend shelf-life through the enhanced quality and bioactive properties of pulse-based snacks. Molecules, 25(16), Artículo 3716. https://doi.org/10.3390/molecules25163716 DOI: https://doi.org/10.3390/molecules25163716
Rigdon, S. E., Pan, R., Montgomery, D. C., & Freeman, L. J. (2022). Design of experiments for reliability achievement. Wiley. https://doi.org/10.1002/9781119237754 DOI: https://doi.org/10.1002/9781119237754
Sheng, X., Cui, Q., Yin, H., Xi, Z., Yi, J., Zhang, H., Xu, X., & Ma, Y. (2025). Application of hydrocolloids in the quality improvement of flour-based products. Trends in Food Science & Technology, 164, Artículo 105211. https://doi.org/10.1016/j.tifs.2025.105211 DOI: https://doi.org/10.1016/j.tifs.2025.105211