Project code: PID2019-104269RR-C33 / AEI / 10.13039/501100011033
Keywords: Wine Vibrational spectroscopy Pattern-recognition Pat Nir spectroscopy Multivariate process control Microfermentation Infrared spectroscopy Chemometrics
Record's date: 2023-02-23
Papper version: info:eu-repo/semantics/publishedVersion
Licence document URL: http://repositori.urv.cat/ca/proteccio-de-dades/
Papper original source: Microchemical Journal. 166 (106215):
APA: Schorn-García D; Cavaglia J; Giussani B; Busto O; Aceña L; Mestres M; Boqué R (2021). ATR-MIR spectroscopy as a process analytical technology in wine alcoholic fermentation – A tutorial. Microchemical Journal, 166(106215), -. DOI: 10.1016/j.microc.2021.106215
Acronym: ALLFRUIT4ALL
Publication Type: Journal Publications
Project code 3: 2020 FISDU 00221
Project code 4: FI_B100154
Author, as appears in the article.: Schorn-García D; Cavaglia J; Giussani B; Busto O; Aceña L; Mestres M; Boqué R
Department: Química Analítica i Química Orgànica
Acronym 2: EnoPAT
URV's Author/s: Aceña Muñoz, Laura / Boqué Martí, Ricard / Busto Busto, Olga / Mestres Solé, Maria Montserrat / Schorn García, Daniel
Abstract: The goal of this article is to guide the reader through the critical points to be faced when monitoring a fermentation following a Process Analytical Technology (PAT) approach. To achieve this purpose Attenuated Total Reflectance – Mid-Infrared (ATR-MIR) spectroscopy coupled to chemometric techniques are proposed. Each of the crucial steps (set up of microvinifications, sampling, spectroscopic analysis and chemometric data treatment) is deeply investigated, revealing how the sampling is decisive for the subsequent modeling phase, suggesting how to set parameters to obtain good quality signals, and explaining how to prepare the data for the chemometric modeling and to perform the calculations. The modeling strategies here presented, based mainly on basic chemometric tools such as principal component analysis and partial least square regression, proved to be effective to the purposes and affordable even for non-expert chemometric users. The article shows, using real examples, how to obtain or predict several parameters from a fermentation data set – control of the fermentation evolution, prediction of oenological parameters during the alcoholic fermentation and detection of deviations from the normal operation condition.
Program founding action 2: Ciencias y tecnologías de los alimentos
Thematic Areas: Spectroscopy Saúde coletiva Química Odontología Nutrição Medicina ii Medicina i Materiais Interdisciplinar Geociências Farmacia Engenharias iv Engenharias iii Engenharias ii Engenharias i Enfermagem Ciências biológicas iii Ciências biológicas ii Ciências biológicas i Ciências ambientais Ciências agrárias i Ciência de alimentos Chemistry, analytical Biotecnología Biodiversidade Astronomia / física Analytical chemistry Administração pública e de empresas, ciências contábeis e turismo
licence for use: https://creativecommons.org/licenses/by/3.0/es/
Founding program action 4: Ayudas para la contratación de personal investigador novel (FI-2018)
ISSN: 0026-265X
Author's mail: daniel.schorn@urv.cat laura.acena@urv.cat olga.busto@urv.cat ricard.boque@urv.cat montserrat.mestres@urv.cat daniel.schorn@urv.cat
Author identifier: 0000-0003-0997-2191 0000-0001-5942-9424 0000-0002-2318-6800 0000-0001-7311-4824 0000-0001-9805-3482 0000-0003-0997-2191
Founding program action 3: Ayudas de apoyo a departamentos y unidades de investigación universitarios para la contratación de personal investigador predoctoral en formación (FI SDUR 2020)
Project code 2: AGL2015-70106-R, AEI/FEDER, UE
Founding program 2: Programa estatal de Investigación, Desarrollo e Innovación orientada a los Retos de la Sociedad, en el marco del Plan estatal de investigación científica y técnica y de innovación 2013-2016
Link to the original source: https://www.sciencedirect.com/science/article/abs/pii/S0026265X2100299X
Funding program: Programa Estatal de Generación de Conocimiento y Fortalecimiento Científico y Tecnológico del Sistema de I+D+i y de I+D+i Orientada a los Retos de la Sociedad. Proyectos de I+D+i Retos Investigación 2017-2020
Founding program 4: Agencia de Gestión de Ayudas Universitarias y de Investigación (AGAUR)
Founding program 3: Agencia de Gestión de Ayudas Universitarias y de Investigación (AGAUR)
Article's DOI: 10.1016/j.microc.2021.106215
Entity: Universitat Rovira i Virgili
Journal publication year: 2021
Funding program action: Ciencias y tecnologías de alimentos
Repositori URV