High-Speed Diagnosis of Bacterial Pathogens at the Single Cell Level by Raman Microspectroscopy with Machine Learning Filters and Denoising Autoencoders.
Jiabao XuXiaofei YiGuilan JinDi PengGaoya FanXiaogang XuXin ChenHuabing YinJonathan M CooperWei E HuangPublished in: ACS chemical biology (2022)
Accurate and rapid identification of infectious bacteria is important in medicine. Raman microspectroscopy holds great promise in performing label-free identification at the single-cell level. However, due to the naturally weak Raman signal, it is a challenge to build extensive databases and achieve both accurate and fast identification. Here, we used signal-to-noise ratio (SNR) as a standard indicator for Raman data quality and performed bacterial identification using 11, 141 single-cell Raman spectra from nine bacterial strains. Subsequently, using two machine learning methods, a simple filter, and a neural network-based denoising autoencoder (DAE), we demonstrated 92% (simple filter using 1 s/cell spectra) and 84% (DAE using 0.1 s/cell spectra) identification accuracy. Our machine learning-aided Raman analysis paves the way for high-speed Raman microspectroscopic clinical diagnostics.
Keyphrases
- single cell
- label free
- high speed
- machine learning
- rna seq
- big data
- atomic force microscopy
- raman spectroscopy
- bioinformatics analysis
- high resolution
- high throughput
- neural network
- artificial intelligence
- escherichia coli
- density functional theory
- mass spectrometry
- bone marrow
- quality improvement
- multidrug resistant
- molecular dynamics
- data analysis