Three-dimensional structural features and the toxicity of aminobenzenes and phenols

来源 :中国科学：化学英文版 | 被引量 : 0次 | 上传用户：mengdewei6677

【摘要】

：

For a QSAR of the toxicity of aminobenzenes in environment and their structures, the projection areas of the molecules in 3D space were calculated. The combinat

【作者】

：

XU Lu(许禄) YANG Jiaan(杨嘉安)

【机构】

：

ChangchunInstituteofAppliedChemistry

【出处】

：

中国科学：化学英文版

【发表日期】

：

2003年5期

【关键词】

：

aminobenzene regression analysis NEURAL network 3D PROJECTION area QSAR. ami

【基金项目】

：

国家自然科学基金

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For a QSAR of the toxicity of aminobenzenes in environment and their structures, the projection areas of the molecules in 3D space were calculated. The combinations of the projection areas and quantum chemical as well as topological parameters were perfor

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Three-dimensional structural features and the toxicity of aminobenzenes and phenols

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