Hazarika, Pankaj and Bezbaruah, Bipul and Das, Pranjali and Medhi, Okhil Kumar and Medhi, Chitrani (2011) A model study on the stacking interaction of phenanthroline ligand with nucleic acid base pairs: An ab initio, MP2 and DFT studies. Journal of Biophysical Chemistry, 02 (02). pp. 153-158. ISSN 2153-036X
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Abstract
The stacking of phenanthroline(phen) ligand within base pair sequences is one of the important factors for the stabilization of metalphen complex within DNA. The stacking ability of this ligand has been assessed to deduce the base pair selectivity as well as to identify the favored region of intercalation. Different level of theories have been used to predict the favorable regions for stacking interaction of phen ligand with base pair, but the results of MP2/6-31+G(d,p) is found to be reasonably good for monitoring such interactions.
Item Type: | Article |
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Subjects: | STM Library > Chemical Science |
Depositing User: | Managing Editor |
Date Deposited: | 09 Feb 2023 07:02 |
Last Modified: | 24 Jun 2024 04:14 |
URI: | http://open.journal4submit.com/id/eprint/1011 |