Please use this identifier to cite or link to this item: https://doi.org/10.3390/molecules28052233
DC FieldValue
dc.titleClassification of the Residues after High and Low Order Explosions Using Machine Learning Techniques on Fourier Transform Infrared (FTIR) Spectra
dc.contributor.authorBanas, Agnieszka M
dc.contributor.authorBanas, Krzysztof
dc.contributor.authorBreese, Mark BH
dc.date.accessioned2023-07-12T06:17:04Z
dc.date.available2023-07-12T06:17:04Z
dc.date.issued2023-03
dc.identifier.citationBanas, Agnieszka M, Banas, Krzysztof, Breese, Mark BH (2023-03). Classification of the Residues after High and Low Order Explosions Using Machine Learning Techniques on Fourier Transform Infrared (FTIR) Spectra. MOLECULES 28 (5). ScholarBank@NUS Repository. https://doi.org/10.3390/molecules28052233
dc.identifier.issn1420-3049
dc.identifier.urihttps://scholarbank.nus.edu.sg/handle/10635/243051
dc.description.abstractForensic science is a field that requires precise and reliable methods for the detection and analysis of evidence. One such method is Fourier Transform Infrared (FTIR) spectroscopy, which provides high sensitivity and selectivity in the detection of samples. In this study, the use of FTIR spectroscopy and statistical multivariate analysis to identify high explosive (HE) materials (C-4, TNT, and PETN) in the residues after high- and low-order explosions is demonstrated. Additionally, a detailed description of the data pre-treatment process and the use of various machine learning classification techniques to achieve successful identification is also provided. The best results were obtained with the hybrid LDA-PCA technique, which was implemented using the R environment, a code-driven open-source platform that promotes reproducibility and transparency.
dc.language.isoen
dc.publisherMDPI
dc.sourceElements
dc.subjectScience & Technology
dc.subjectLife Sciences & Biomedicine
dc.subjectPhysical Sciences
dc.subjectBiochemistry & Molecular Biology
dc.subjectChemistry, Multidisciplinary
dc.subjectChemistry
dc.subjecthigh and low order explosions
dc.subjectmachine learning techniques
dc.subjectFourier Transform Infrared (FTIR) spectroscopy
dc.subjectspectral analysis
dc.subjectexplosive residues
dc.subjectSPECTROSCOPY
dc.typeArticle
dc.date.updated2023-07-12T03:54:12Z
dc.contributor.departmentPHYSICS
dc.contributor.departmentSINGAPORE SYNCHROTRON LIGHT SOURCE
dc.description.doi10.3390/molecules28052233
dc.description.sourcetitleMOLECULES
dc.description.volume28
dc.description.issue5
dc.published.statePublished
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