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定量的構造活性相関
Wikipedia definition
1. Quantitative structure–activity relationship​Quantitative structure–activity relationship models (QSAR models) are regression models used in the chemical and biological sciences and engineering. Like other regression models, QSAR models relate measurements on a set of "predictor" variables to the behavior of the response variable. In QSAR modeling, the predictors consist of properties of chemicals; the QSAR response-variable is a the biological activity of the chemicals.
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