A novel approach for the virtual screening and rational design of anticancer compounds.
Published in Journal of medicinal chemistry • May 18, 2000
Authors:,,
E Estrada
E Uriarte
A Montero
Abstract
A topological substructural approach to molecular design (TOSS-MODE) has been introduced for the selection and design of anticancer compounds. A quantitative model that discriminates anticancer compounds from the inactive ones in a training series was obtained. This model permits the correct classif...
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