Informace o publikaci
Transformation of a Free-Wilson Matrix into Fourier Coefficients
| Autoři | |
|---|---|
| Rok publikování | 2001 |
| Druh | Článek v odborném periodiku |
| Časopis / Zdroj | Quant. Struct.-Act. Relat. |
| Fakulta / Pracoviště MU | |
| Citace | |
| Obor | Fyzikální chemie a teoretická chemie |
| Klíčová slova | Free-Wilson matrix; Fourier transform; multivariate regression; standard error of prediction; statistical importance of the regression |
| Popis | Fourier Transform is suggested as a way to change site and substituent oriented variables into new only latently dependent ones. It is possible to find out a model with a low standard error of prediction, SEP%, of activity for not yet prepared compounds. Testing power of the correlation coefficient is improved by calculating a probability, PR, that the regression is made only by chance. |
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