Title of article :
Study of 3D-quantitative structure–activity relationship on a set of 1,2,4-triazole compounds
Author/Authors :
Xiao، نويسنده , , Y.D and Wei، نويسنده , , L.H. and WANG، نويسنده , , J.T and Zhang، نويسنده , , J.B and Lin، نويسنده , , S.F and Zhou، نويسنده , , Z.H، نويسنده ,
Issue Information :
دوفصلنامه با شماره پیاپی سال 1999
Abstract :
In this article, 3D-quantitative structure–activity relationship on a set of 1,2,4-triazole compounds is studied. A set of 16 derivatives of triazole that have different biological activities to wheat black rust as inhibitors are characterized by molecular mechanics. The analysis result by PLS agrees with the study of 2D-QSAR, and it offers useful 3-dimensional information for designing high activity compounds.
Keywords :
1 , 2 , 4-Triazole , Inhibitor of wheat black rust , PLS analysis , 3D-QSAR
Journal title :
Chemometrics and Intelligent Laboratory Systems
Journal title :
Chemometrics and Intelligent Laboratory Systems
