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利用表面增强拉曼光谱的深度学习实现开放集细菌识别

Deep learning enabled open-set bacteria recognition using surface-enhanced Raman spectroscopy.

作者信息

Cao Hanyu, Cheng Jie, Ma Xing, Liu Shan, Guo Jinhong, Li Diangeng

机构信息

School of Sensing Science and Engineering, Shanghai Jiao Tong University, 800 Dongchuan RD. Minhang District, Shanghai, 200240, China.

School of Integrated Circuits, Harbin Institute of Technology (Shenzhen), HIT Campus of University Town of Shenzhen, Shenzhen, 518055, China.

出版信息

Biosens Bioelectron. 2025 May 15;276:117245. doi: 10.1016/j.bios.2025.117245. Epub 2025 Feb 14.

Abstract

Accurate bacterial identification is vital in medical and healthcare settings. Traditional methods, though reliable, are often time-consuming, underscoring the need for faster, more efficient alternatives. Deep learning-assisted Surface-enhanced Raman spectroscopy (SERS) offers a rapid and sensitive method, demonstrating high accuracy in bacterial identification. However, current deep learning models for bacterial SERS spectra classification typically operate under a closed-set paradigm, limiting their effectiveness when encountering bacterial species outside the training set. In response to this challenge, we propose a transformer-based neural network for open-set bacterial recognition using SERS spectra. Our model utilizes a combination of classification and reconstruction tasks, rejecting unknown species by analyzing reconstruction errors. Experimental results show that the proposed model outperforms traditional open-set recognition approaches, providing superior accuracy in both classifying known species and rejecting unknown ones. This study addresses the limitations of existing closed-set methods, improving the robustness of bacterial identification in real-world scenarios and demonstrating the potential of integrating SERS with transformer models for medical and healthcare applications.

摘要

准确的细菌鉴定在医疗和卫生保健环境中至关重要。传统方法虽然可靠,但往往耗时较长,这凸显了对更快、更高效替代方法的需求。深度学习辅助的表面增强拉曼光谱(SERS)提供了一种快速且灵敏的方法,在细菌鉴定中显示出高精度。然而,当前用于细菌SERS光谱分类的深度学习模型通常在封闭集范式下运行,在遇到训练集之外的细菌物种时会限制其有效性。为应对这一挑战,我们提出了一种基于Transformer的神经网络,用于使用SERS光谱进行开放集细菌识别。我们的模型利用分类和重建任务的组合,通过分析重建误差来拒绝未知物种。实验结果表明,所提出的模型优于传统的开放集识别方法,在对已知物种进行分类和拒绝未知物种方面都提供了更高的准确性。本研究解决了现有封闭集方法的局限性,提高了现实场景中细菌鉴定的鲁棒性,并展示了将SERS与Transformer模型集成用于医疗和卫生保健应用的潜力。

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