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基于溶血磷脂的深度学习模型的开发与评估,用于区分白米的地理来源。

Development and assessment of a lysophospholipid-based deep learning model to discriminate geographical origins of white rice.

机构信息

Research Institute of Pharmaceutical Sciences and College of Pharmacy, Seoul National University, Seoul, 08826, Republic of Korea.

National Institute of Agricultural Sciences, Rural Development Administration, Jeonju, 54875, Republic of Korea.

出版信息

Sci Rep. 2017 Aug 17;7(1):8552. doi: 10.1038/s41598-017-08892-0.

Abstract

Geographical origin determination of white rice has become the major issue of food industry. However, there is still lack of a high-throughput method for rapidly and reproducibly differentiating the geographical origins of commercial white rice. In this study, we developed a method that employed lipidomics and deep learning to discriminate white rice from Korea to China. A total of 126 white rice of 30 cultivars from different regions were utilized for the method development and validation. By using direct infusion-mass spectrometry-based targeted lipidomics, 17 lysoglycerophospholipids were simultaneously characterized within minutes per sample. Unsupervised data exploration showed a noticeable overlap of white rice between two countries. In addition, lysophosphatidylcholines (lysoPCs) were prominent in white rice from Korea while lysophosphatidylethanolamines (lysoPEs) were enriched in white rice from China. A deep learning prediction model was built using 2014 white rice and validated using two different batches of 2015 white rice. The model accurately discriminated white rice from two countries. Among 10 selected predictors, lysoPC(18:2), lysoPC(14:0), and lysoPE(16:0) were the three most important features. Random forest and gradient boosting machine models also worked well in this circumstance. In conclusion, this study provides an architecture for high-throughput classification of white rice from different geographical origins.

摘要

大米的产地鉴别已成为食品行业的主要问题。然而,目前仍然缺乏一种高通量、快速且可重现的方法来区分商业白米的产地。本研究开发了一种基于脂质组学和深度学习的方法,用于鉴别韩国和中国的白米。利用直接进样-质谱靶向脂质组学,在几分钟内即可同时鉴定 30 个不同品种、来自不同地区的 126 种白米中的 17 种甘油磷脂。无监督数据分析表明,两国的白米存在明显的重叠。此外,韩国白米中富含溶血磷脂酰胆碱(lysoPC),而中国白米中富含溶血磷脂酰乙醇胺(lysoPE)。该模型使用 2014 年的白米进行构建,并使用 2015 年的两个不同批次的白米进行验证。该模型能够准确区分来自两个国家的白米。在 10 个选定的预测因子中,lysoPC(18:2)、lysoPC(14:0)和 lysoPE(16:0)是三个最重要的特征。随机森林和梯度提升机模型在这种情况下也表现良好。总之,本研究为不同产地的白米高通量分类提供了一种架构。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/31c0/5561257/1f833597102f/41598_2017_8892_Fig1_HTML.jpg

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