Predictive QSAR modeling of HIV reverse transcriptase inhibitor TIBO derivatives.

@article{Mandal2009PredictiveQM,
  title={Predictive QSAR modeling of HIV reverse transcriptase inhibitor TIBO derivatives.},
  author={Asim Sattwa Mandal and Kunal Roy},
  journal={European journal of medicinal chemistry},
  year={2009},
  volume={44 4},
  pages={
          1509-24
        }
}
Comparative quantitative structure-activity relationship (QSAR) studies have been carried out on tetrahydroimidazo[4,5,1-jk][1,4]benzodiazepine (TIBO) derivatives as reverse transcriptase inhibitors (n=70) using topological, structural, physicochemical, electronic and spatial descriptors. The data set was divided into training and test sets using a cluster-based method. Linear models were developed using multiple regression (with stepwise regression, factor analysis and genetic function… CONTINUE READING

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