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QSPR/QSAR Studies of 2-Furylethylenes Using Bond-Level Quadratic Indices and Comparison with Other Computational Approaches

The recently introduced, non-stochastic and stochastic qua - dratic indices (Marrero-Ponce et al. J. Comp. Aided Mol. Des. 2006 , 20 , 685-701) were applied to QSAR/QSPR studies of heteroatomic molecules. These novel bond-based molecular descriptors (MDs) were used for the prediction of the partitio...

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Bibliografische gegevens
Gepubliceerd in:Journal of the Mexican Chemical Society
Hoofdauteurs: Eugenio R. Martinez Albelo, Yovani Marrero Ponce, Stephen J. Barigye, Yunaimy Echeverría-Díaz, Facundo Pérez-Giménez
Formaat: Artigo
Taal:Inglês
Gepubliceerd in: Sociedad Química de México 2013
Onderwerpen:
non
Online toegang:https://www.redalyc.org/articulo.oa?id=47527412012
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