3-D QSAR Studies on Thiazole and Triazole Antifungal Agents by CoMFA and CoMSIA

  • Published : 2003.04.01

Abstract

3D-QSAR analyses by CoMFA and CoMSIA were conducted on a series of thiazole and triazole analogues with respect to their antifungal activities against Microsporum gypseum. A total of twenty analogues were used for the derivation of the 3D-QSAR models (training set). Thesuperposition of the compounds was performed by applying the FlexS with shape-based screening method. (omitted)

Keywords