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Title: Conformational analysis of cytidine with cobaloximes
Authors: Madhuri, J V
Satyanarayana, S
Keywords: binding;cobaloximes;conformational analysis;conformer;DNA
Issue Date: Oct-2004
Publisher: CSIR
IPC Code: Int. Cl.7 C 07 C 251/00, C 07 H 19/073 // A 61 K
Abstract: The structure of cytidine bound with alkyl cobaloximes was optimized using molecular mechanics. By means of CONFLEX, an extensive conformational search was undertaken using Bio Med Cache 5.02 software, which generated numerous conformations and finally arrived at the lowest energy conformer. The conformational search is crucial for discovering new drugs where the conformation of the pharmacaphore is important.
Page(s): 599-602
ISSN: 0975-0967 (Online); 0972-5849 (Print)
Appears in Collections:IJBT Vol.03(4) [October 2004]

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