Vikramjeet Judge

TL;DR: The results of the present study indicated that compounds 15, 17 and 24 might be of interest for the identification of new antimicrobial molecules as their antibacterial activity is equivalent to the standard drug norfloxacin.

TL;DR: Topological parameters especially molecular connectivity indices were found to have overall significant correlation with antimicrobial activity of 2,4-hexadienoic acid derivatives, which gave reliability to the prediction of molecules with activity using QSAR models.

TL;DR: The mt-QSAR model indicated that the topological parameters, second order molecular connectivity index and third order Kier's alpha shape index are effective in describing the antimicrobial activity of synthesized hydrazides.

TL;DR: QSAR investigation was performed by the development of one-target and multi-target models and indicated the importance of the topological parameter, valence third order molecular connectivity index (3)chi(v) and the electronic parameter, energy of highest occupied molecular orbital (HOMO) in describing the antimicrobial activity of substituted hydrazides.

TL;DR: The multi-target QSAR models were found to be effective in predicting the antimicrobial activity of the isoniazid derivatives and indicated the importance of nuclear repulsion energy (Nu.E) in explaining the antimacterial activity of isoniaZid derivatives.