QSPR Modeling using Catalan Solvent and Solute Parameters
نویسندگان
چکیده
منابع مشابه
QSPR Treatment of Solvent Scales
The results of the quantitative structure-property relationship (QSPR) analysis of 45 different solvent scales and 350 solvents using the CODESSA program are presented. The QSPR models for each of the scales are constructed using only theoretical descriptors. The high quality of the models (32 of the 45 give R2 > 0.90, only two have R2 < 0.82) enables direct calculation of predicted values for ...
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ژورنال
عنوان ژورنال: Journal of the Brazilian Chemical Society
سال: 2011
ISSN: 0103-5053
DOI: 10.1590/s0103-50532011000400011