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ISSN: 2333-9721
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Quantitative structure-activity relationship of estrogen activities of bisphenol A analogs

Keywords: bisphenol A analogs,endocrine disrupting chemicals,molecular electronegativity-distance vector,best subset regression
双酚A类似物
,内分泌紊乱化学制品,分子负电性距离向量,雌激素,定量构效关系

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Abstract:

The molecular electronegativity-distance vector (MEDV) is employed to describe the chemical structure of bisphenol A analogs and their correlated estrogen activities. The result shows that the constructed models have good predictability and indicates substructures that may influence estrogen activities of chemicals.

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