线性判别分析
主成分分析
化学计量学
偏最小二乘回归
多元统计
葡萄酒
近红外光谱
多元分析
数学
统计
模式识别(心理学)
化学
人工智能
色谱法
计算机科学
食品科学
生物
神经科学
作者
Liang Liu,Daniel Cozzolino,Wies Cynkar,Mark Gishen,C. Colby
摘要
Visible (vis) and near-infrared (NIR) spectroscopy combined with multivariate analysis was used to classify the geographical origin of commercial Tempranillo wines from Australia and Spain. Wines (n = 63) were scanned in the vis and NIR regions (400−2500 nm) in a monochromator instrument in transmission. Principal component analysis (PCA), discriminant partial least-squares discriminant analysis (PLS-DA) and linear discriminant analysis (LDA) based on PCA scores were used to classify Tempranillo wines according to their geographical origin. Full cross-validation (leave-one-out) was used as validation method when PCA and LDA classification models were developed. PLS-DA models correctly classified 100% and 84.7% of the Australian and Spanish Tempranillo wine samples, respectively. LDA calibration models correctly classified 72% of the Australian wines and 85% of the Spanish wines. These results demonstrate the potential use of vis and NIR spectroscopy, combined with chemometrics as a rapid method to classify Tempranillo wines accordingly to their geographical origin. Keywords: Near-infrared; principal component analysis; discriminant partial least-squares; linear discriminant analysis; Tempranillo; wine; geographical origin
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