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    STUDIA CHEMIA - Issue no. 2 / 2018  
         
  Article:   DOCKING OF INDOLIZINE DERIVATIVES ON CUBE RHOMBELLANE FUNCTIONALIZED HOMEOMORPHS.

Authors:  BEATA SZEFLER, PRZEMYSŁAW CZELEŃ, MIRCEA V. DIUDEA.
 
       
         
  Abstract:  Indolizines represent a class of heteroaromatic compounds (of pharmacological importance) containing two condensed (5- and 6 -memebered) rings bridged by a nitrogen atom, showing a variety of biological activities. An attempt was made to deposit indolizines on the cube rhombellane homeomorphs surface as possible nano-drug complexes, since rhombellane homeomorphs may be bound in a protein as the active pocket and further may be used in personalized medicine. In the present study, a molecular docking analysis of two indolizine derivatives on some cube rhombellane homeomorphs was carried out for the first time.

Keywords: binding energy, indolizine, molecular docking, nanostructure, cube rhombellane homeomorph.
 
         
     
         
         
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