The STUDIA UNIVERSITATIS BABEŞ-BOLYAI issue article summary

The summary of the selected article appears at the bottom of the page. In order to get back to the contents of the issue this article belongs to you have to access the link from the title. In order to see all the articles of the archive which have as author/co-author one of the authors mentioned below, you have to access the link from the author's name.

 
       
         
    STUDIA CHEMIA - Issue no. 3 / 2012  
         
  Article:   CORRELATING STUDY ON PHISYCO-CHEMICAL AND BIOLOGICAL PROPERTIES OF THIOSEMICARBAZONE AND THIADIAZOLINE DERIVATIVES.

Authors:  .
 
       
         
  Abstract:  

Thiadiazolines and Thiosemicarbazones represent classes of well-known molecular structures with important biological activities. The set of twenty structures, synthesized in our lab, was characterized about lipophilicity by reverse phase thin layer chromatography (RPTLC) and tested for their antimicrobial activities. These molecular properties were modeled by using topological and quantum descriptors, in the frame of a hypermolecule, with the meaning of a “mean molecule” in the set. A general procedure for developing and validating the models using the above concept is given. Within this frame, a method of data reduction (i.e., selection of relevant descriptors) was exemplified.

Keywords: thiosemicarbazone, thiadiazoline, hypermolecule, molecular descriptor, QSPR, QSAR

 
         
     
         
         
      Back to previous page