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- W2365148833 abstract "Support vector machines algorithm was applied to study the quantitative structure-activity relationship of 39 apoptosis-inducing 4-aryl-4H-chromenes.The eleven kinds of molecular characteristic parameters were calculated and optimized by stepwise multiple regression.A more predictive model was set up through optimizing kernel function parameters.The squared correlation coefficient(R2) values between experimental versus calculated values for 30 molecules in the training set and 9 molecules in the test set are 0.997 and 0.893,respectively.The satisfactory results showed that support vector regression algorithm would be well used for drug molecules design." @default.
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- W2365148833 date "2009-01-01" @default.
- W2365148833 modified "2023-09-24" @default.
- W2365148833 title "Support vector machine applied to research the apoptosis-inducing activity of 4-aryl-4H-chromenes compounds" @default.
- W2365148833 hasPublicationYear "2009" @default.
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