ATS药物分子结构二维和三维形状表示的矩不变旋转分析

S. A. Bero, A. Muda, Y. Choo, N. A. Muda, S. F. Pratama
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引用次数: 2

摘要

如今,世界各地的人们滥用药物的情况越来越严重,而且还在增加。安非他明类兴奋剂(ATS)药物是世界上流行的药物之一。这种药物是两种药物的组合;安非他明和摇头丸。在这个项目中,我们专注于两种不同的技术,用于比较2D和3D ATS药物分子的结果。除此之外,这个项目也在寻找制作2D和3D图像的最佳技术。联合矩不变(UMI)和霍夫变换(HT)是将用于提取ATS药物二维和三维分子结构数据的特征提取方法。随后,提取的数据将被处理到WEKA中,以提高两种分子结构的分类精度。综上所述,MI和HT技术肯定会提供不同的结果,但两种技术都可以很好地处理ATS分子结构。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Rotation analysis of moment invariant for 2D and 3D shape representation for molecular structure of ATS drugs
Drug abuse among the people around the world is getting serious and increase nowadays. An Amphetamine-Type Stimulant (ATS) drug is one of the popular drugs in the world. This kind of drug is a combination of two types of drugs; amphetamine and ecstasy. In this project, we are focusing on two different techniques used to compare the result between 2D and 3D ATS drug molecule. Besides that, this project is also looking for the best technique to produce 2D and 3D images. United Moment Invariant (UMI) and Hough Transform (HT) are the feature extraction methods that will be used to extract data from both 2D and 3D molecular structure of the ATS drugs. Later, the extracted data will be processed into WEKA for classification accuracies for both molecular structures. As a conclusion, the MI and the HT technique will definitely provide different results, but both techniques will perform well with the ATS molecular structure.
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