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`Correlation and Prediction of the Refractive lndices of Polymers by QSPR - Journal of Chemical Information and Modeling (ACS Publications)
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`Correlation and Prediction of the Refractive lndices of Polymers by QSPR
`
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`Alan
`Center for Heterocyclic Compounds, University of Florida, Gainesville, Florida 32611-7200, and Institute of Chemical
`Physics, University of Tartu, 2 Jakobi Street, EE 2400 Tartu, Estonia
`J. Chem. Inf. Comput. Sci., 1998, 38(6), pp 1171-1176
`DOI: 10.1021/ci980087w
`Publication Date (Web): October 22, 1998
`Copyright © 1993 American Chemical Society
`
`Abstract
`
`A general QSPR model (R2 = 0.940, s = 0.018) was developed for the prediction of the refractive
`index for a diverse set of amorphous homopolymers with the CODESSA program. The five
`descriptors, involved in the model, are calculated from the structure of the repeating unit of the
`polymer. The average prediction error by this model is 0.9%.
`
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`Katritzky, Alan R.
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`Received 25 May 1998
`Published online 22 October 1998
`Published in print 1 November 1998
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`http://pubs.acs.org/doi/abs/10.1021/ci980087w
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`Correlation and Prediction of the Refractive Indices of Polymers by QSPR - Journal of Chemical Inform ation and Modeling (ACS Publications)
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