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International Journal of Medicinal Chemistry
Volume 2013, Article ID 495134, 6 pages
Research Article

The Development of Models Based on Linear and Nonlinear Multivariate Methods to Predict ADME/PK Properties Using Physicochemical Properties of Kinase, Protease Inhibitors, and GPCR Antagonists

1Department of Biotechnology, PES Institute of Technology, Bangalore 560068, India
2Department of Biotechnology, The Oxford College of Engineering, Bangalore 560068, India

Received 27 December 2012; Revised 4 February 2013; Accepted 14 February 2013

Academic Editor: Armando Rossello

Copyright © 2013 Deepu Bakasta and M. G. Shambhu. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

Supplementary Material

Table 1 represents supplementary data for training data and test data.

Table 2 represents supplementary data for A Total of 11descriptors were generated for each of the 217 compounds using Codessa 2.1 tool.

  1. Supplementary Tables