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Biological-Activity Predictions and Hydrogen Bonding Analysis in Chalcones: A Review

机译:Chalcones的生物活性预测和氢键分析:综述。

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The paper has been designed to make a comprehensive review of a particular series of organic molecular assembly in the form of compendium. An overview of general description of twenty-two chalcone derivatives has been given. The biological activity spectra of chalcone derivatives have been correlated on structure activity relationships base which provides the different P_a (possibility of activity) and P_i (possibility of inactivity) values. Expositions of the role of intermolecular interactions in the identified derivatives have been discussed with the standard distance and angle cut-off criteria criteria as proposed by Desiraju and Steiner (1999) in an International monogram on crystallography. Histogram chart has been drawn to show the relative frequency of-occurrence of intermolecular hydrogen bonds in chalcone derivatives. Distance-angle scatter plots for inter-molecular interactions are presented for a better understanding of the packing interactions which exist in chalcone derivatives.
机译:本文旨在以汇编的形式全面审查特定系列的有机分子组装。已概述了二十二个查耳酮衍生物。查耳酮衍生物的生物活性谱已在结构活性关系的基础上相关联,该关系提供了不同的P_a(活性可能性)和P_i(无活性可能性)值。分子间相互作用在鉴定出的衍生物中的作用的描述已由Desiraju和Steiner(1999)在国际晶体学会标中提出的标准距离和角度截止标准标准进行了讨论。绘制了直方图,以显示查尔酮衍生物中分子间氢键的相对出现频率。提出了分子间相互作用的距离角散射图,以更好地了解查尔酮衍生物中存在的堆积相互作用。

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