Hubungan Kuantitatif Struktur Elektronik dan Aktivitas Inhibisi Senyawa Kurkumin pada Reaksi Etoksiresorufin O-Dealkilasi (EROD)

ABSTRACT: Electronic structure and inhibition activity relationship study of curcumin analogs has been established for 29 curcumin analogs on Ethoxyresorufin O-Dealkylation (EROD) reaction using atomic net charge descriptor based on AM1 semiempirical calculations. The QSAR (Quantitative Structure and Activities Relationships) equation model was determined by statistical parameter from multiple regression analysis and leave-one-out cross validation method. The best QSAR equation was described:
Keywords: curcumin, QSAR, descriptor, atomic net charge, semiempirical methods
Penulis: Harno Dwi Pranowo, Iqmal Tahir, Ajidarma Widiatmoko
Kode Jurnal: jpkimiadd070086

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