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Development of an automated data processing method for sample to sample comparison of seized methamphetamines

机译:开发了一种自动数据处理方法,用于样品与缉获的甲基苯丙胺的样品比较

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The information about the sources of supply, trafficking routes, distribution patterns and conspiracy links can be obtained from methamphetamine profiling. The precursor and synthetic method for the clandestine manufacture can be estimated from the analysis of minor impurities contained in methamphetamine. Also, the similarity between samples can be evaluated using the peaks that appear in chromatograms. In South Korea, methamphetamine was the most popular drug but the total seized amount of methamphetamine whole through the country was very small. Therefore, it would be more important to find the links between samples than the other uses of methamphetamine profiling. Many Asian countries including Japan and South Korea have been using the method developed by National Research Institute of Police Science of Japan. The method used gas chromatography-flame ionization detector (GC-FID), DB-5 column and four internal standards. It was developed to increase the amount of impurities and minimize the amount of methamphetamine. After GC-FID analysis, the raw data have to be processed. The data processing steps are very complex and require a lot of time and effort. In this study, Microsoft Visual Basic Application (VBA) modules were developed to handle these data processing steps. This module collected the results from the data into an Excel file and then corrected the retention time shift and response deviation generated from the sample preparation and instruments analysis. The developed modules were tested for their performance using 10 samples from 5 different cases. The processed results were analyzed with Pearson correlation coefficient for similarity assessment and the correlation coefficient of the two samples from the same case was more than 0.99. When the modules were applied to 131 seized methamphetamine samples, four samples from two different cases were found to have the common origin and the chromatograms of the four samples were appeared visually identical. The developed VBA modules could process raw data of GC-FID very quickly and easily. Also, they could assess the similarity between samples by peak pattern recognition using whole peaks without spectral identification of each peak that appeared in the chromatogram. The results collectively suggest that the modules would be useful tools to augment similarity assessment between seized methamphetamine samples.
机译:有关供应来源,贩运路线,分配方式和阴谋联系的信息可从甲基苯丙胺分析中获得。秘密制造的前体和合成方法可以通过分析甲基苯丙胺中的微量杂质来估算。同样,可以使用色谱图中出现的峰评估样品之间的相似性。在韩国,甲基苯丙胺是最受欢迎的药物,但整个国家的甲基苯丙胺缉获总量很小。因此,找到样品之间的联系比使用甲基苯丙胺分析的其他用途更为重要。许多亚洲国家,包括日本和韩国,一直在使用日本国立警察科学研究所开发的方法。该方法使用气相色谱-火焰电离检测器(GC-FID),DB-5色谱柱和四个内标。开发它是为了增加杂质的量并使甲基苯丙胺的量最小化。经过GC-FID分析后,必须处理原始数据。数据处理步骤非常复杂,需要大量时间和精力。在本研究中,开发了Microsoft Visual Basic应用程序(VBA)模块来处理这些数据处理步骤。该模块将数据中的结果收集到一个Excel文件中,然后校正从样品制备和仪器分析产生的保留时间偏移和响应偏差。使用来自5个不同案例的10个样本测试了开发的模块的性能。用Pearson相关系数对处理后的结果进行相似性评估,来自同一案例的两个样本的相关系数大于0.99。当将模块应用于131份缉获的甲基苯丙胺样品时,发现来自两个不同案例的四个样品具有共同的起源,并且四个样品的色谱图在视觉上看起来是相同的。开发的VBA模块可以非常快速,轻松地处理GC-FID的原始数据。同样,他们可以使用整个峰通过峰模式识别来评估样品之间的相似性,而无需对色谱图中出现的每个峰进行光谱鉴定。结果共同表明,这些模块将是增强缉获的甲基苯丙胺样品之间相似性评估的有用工具。

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