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Prediction of Biological Activity Spectra for Substances: in House Applications and Internet Feasibility
Published: 01 November 1998 by MDPI in The 2nd International Electronic Conference on Synthetic Organic Chemistry session Information and Compound Archives Management and Internet Application
Abstract: Computer prediction of biological activity spectra for drug-like organic substances is presented. New leads found on the basis of predicted biological activity spectra are considered. Possibilities for in house and Internet applications of this approach in computer-aided drug discovery are discussed.
Keywords: biological activity spectrum, computer-aided prediction, computer system PASS (Prediction of Activity Spectra for Substances), applications in computer-aided drug discovery, prediction via Internet