Modeling of sulfonamide using NMR chemical shift by QSDAR Method

Asmita Sharma¹ , Anubha Vijay Pandya²

Section:Research Paper, Product Type: Isroset-Conference
Vol.1 , Issue.1 , pp.1-8, Dec-2014

Online published on Jan 05, 2014

Copyright © Asmita Sharma , Anubha Vijay Pandya . 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.
 

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Abstract :
The paper describes the estimation of chemical shifts in NMR using Balaban and Balaban type indices. Further attempt is made of using NMR chemical shift along with the above indices for modeling carbonic anhydrase inhibition. The statistically significant models are governed by a variety of statistical parameter.

Key-Words / Index Term :
QSAR Method, Carbonic Anhydrase Inhibition activity. Topological Indices, NMR Chemical Shift

References :
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