William Feeney , Korina Menking-Hoggatt , Luis Arroyo , James Curran , Suzanne Bell , Tatiana Trejos
{"title":"用LC-MS/MS评价不同人群中有机和无机枪弹残留物","authors":"William Feeney , Korina Menking-Hoggatt , Luis Arroyo , James Curran , Suzanne Bell , Tatiana Trejos","doi":"10.1016/j.forc.2021.100389","DOIUrl":null,"url":null,"abstract":"<div><p>This work investigated the prevalence of organic and inorganic gunshot residue within two main subpopulations, 1) non-shooters, including groups with low- and high-risk of potentially containing GSR-like residues, and 2) individuals involved in a firing event (shooters, bystanders, and shooters performing post-shooting activities). The study analyzed over 400 samples via a liquid chromatography-mass spectrometry (LC-MS/MS) methodology with complexing agents. Exploratory statistical tools and machine learning algorithms (neural networks, NN) were used to evaluate the resulting mass spectral and quantitative data. This study observed lower occurrences of OGSR compounds in the non-shooter populations compared to IGSR analytes. The presence of GSR on authentic shooters versus other potential sources of false positives, such as bystanders and professions including police officers, agricultural workers, and mechanics, were further assessed by utilizing machine learning algorithms trained with the observed OGSR/IGSR traces. The probability of false negatives was also estimated with groups who performed regular activities after firing. Additionally, the low-risk background set allowed documentation of GSR occurrence in the general population. The probabilistic outputs of the neural network models were utilized to calculate likelihood ratios (LR) to measure the weight of the evidence. Using both the IGSR and OGSR profiles, the NN model’s accuracy ranged from 90 to 99%, depending on the subpopulation complexity. The log-LR histograms and Tippet plots show the method can discriminate between each sub-population and low rates of misleading evidence, suggesting that the proposed approach can be effectively used for a probabilistic interpretation of GSR evidence.</p></div>","PeriodicalId":324,"journal":{"name":"Forensic Chemistry","volume":"27 ","pages":"Article 100389"},"PeriodicalIF":2.6000,"publicationDate":"2022-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Evaluation of organic and inorganic gunshot residues in various populations using LC-MS/MS\",\"authors\":\"William Feeney , Korina Menking-Hoggatt , Luis Arroyo , James Curran , Suzanne Bell , Tatiana Trejos\",\"doi\":\"10.1016/j.forc.2021.100389\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>This work investigated the prevalence of organic and inorganic gunshot residue within two main subpopulations, 1) non-shooters, including groups with low- and high-risk of potentially containing GSR-like residues, and 2) individuals involved in a firing event (shooters, bystanders, and shooters performing post-shooting activities). The study analyzed over 400 samples via a liquid chromatography-mass spectrometry (LC-MS/MS) methodology with complexing agents. Exploratory statistical tools and machine learning algorithms (neural networks, NN) were used to evaluate the resulting mass spectral and quantitative data. This study observed lower occurrences of OGSR compounds in the non-shooter populations compared to IGSR analytes. The presence of GSR on authentic shooters versus other potential sources of false positives, such as bystanders and professions including police officers, agricultural workers, and mechanics, were further assessed by utilizing machine learning algorithms trained with the observed OGSR/IGSR traces. The probability of false negatives was also estimated with groups who performed regular activities after firing. Additionally, the low-risk background set allowed documentation of GSR occurrence in the general population. The probabilistic outputs of the neural network models were utilized to calculate likelihood ratios (LR) to measure the weight of the evidence. Using both the IGSR and OGSR profiles, the NN model’s accuracy ranged from 90 to 99%, depending on the subpopulation complexity. The log-LR histograms and Tippet plots show the method can discriminate between each sub-population and low rates of misleading evidence, suggesting that the proposed approach can be effectively used for a probabilistic interpretation of GSR evidence.</p></div>\",\"PeriodicalId\":324,\"journal\":{\"name\":\"Forensic Chemistry\",\"volume\":\"27 \",\"pages\":\"Article 100389\"},\"PeriodicalIF\":2.6000,\"publicationDate\":\"2022-03-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Forensic Chemistry\",\"FirstCategoryId\":\"3\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S2468170921000850\",\"RegionNum\":3,\"RegionCategory\":\"医学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, ANALYTICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Forensic Chemistry","FirstCategoryId":"3","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S2468170921000850","RegionNum":3,"RegionCategory":"医学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, ANALYTICAL","Score":null,"Total":0}
Evaluation of organic and inorganic gunshot residues in various populations using LC-MS/MS
This work investigated the prevalence of organic and inorganic gunshot residue within two main subpopulations, 1) non-shooters, including groups with low- and high-risk of potentially containing GSR-like residues, and 2) individuals involved in a firing event (shooters, bystanders, and shooters performing post-shooting activities). The study analyzed over 400 samples via a liquid chromatography-mass spectrometry (LC-MS/MS) methodology with complexing agents. Exploratory statistical tools and machine learning algorithms (neural networks, NN) were used to evaluate the resulting mass spectral and quantitative data. This study observed lower occurrences of OGSR compounds in the non-shooter populations compared to IGSR analytes. The presence of GSR on authentic shooters versus other potential sources of false positives, such as bystanders and professions including police officers, agricultural workers, and mechanics, were further assessed by utilizing machine learning algorithms trained with the observed OGSR/IGSR traces. The probability of false negatives was also estimated with groups who performed regular activities after firing. Additionally, the low-risk background set allowed documentation of GSR occurrence in the general population. The probabilistic outputs of the neural network models were utilized to calculate likelihood ratios (LR) to measure the weight of the evidence. Using both the IGSR and OGSR profiles, the NN model’s accuracy ranged from 90 to 99%, depending on the subpopulation complexity. The log-LR histograms and Tippet plots show the method can discriminate between each sub-population and low rates of misleading evidence, suggesting that the proposed approach can be effectively used for a probabilistic interpretation of GSR evidence.
期刊介绍:
Forensic Chemistry publishes high quality manuscripts focusing on the theory, research and application of any chemical science to forensic analysis. The scope of the journal includes fundamental advancements that result in a better understanding of the evidentiary significance derived from the physical and chemical analysis of materials. The scope of Forensic Chemistry will also include the application and or development of any molecular and atomic spectrochemical technique, electrochemical techniques, sensors, surface characterization techniques, mass spectrometry, nuclear magnetic resonance, chemometrics and statistics, and separation sciences (e.g. chromatography) that provide insight into the forensic analysis of materials. Evidential topics of interest to the journal include, but are not limited to, fingerprint analysis, drug analysis, ignitable liquid residue analysis, explosives detection and analysis, the characterization and comparison of trace evidence (glass, fibers, paints and polymers, tapes, soils and other materials), ink and paper analysis, gunshot residue analysis, synthetic pathways for drugs, toxicology and the analysis and chemistry associated with the components of fingermarks. The journal is particularly interested in receiving manuscripts that report advances in the forensic interpretation of chemical evidence. Technology Readiness Level: When submitting an article to Forensic Chemistry, all authors will be asked to self-assign a Technology Readiness Level (TRL) to their article. The purpose of the TRL system is to help readers understand the level of maturity of an idea or method, to help track the evolution of readiness of a given technique or method, and to help filter published articles by the expected ease of implementation in an operation setting within a crime lab.