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 Найдено научных статей и публикаций: 1, для научной тематики: principal compounds


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1.

Robustness of biological activity spectra predicting by computer program PASS for non-congeneric sets of chemical compounds (публикация автора на scipeople)   

Poroikov V.V., Filimonov D.A., Borodina Yu. V., Lagunin A.A., Kos A. - Journal of Chemical Information and Computer Sciences , 2000
The computer system PASS provides simultaneous prediction of several hundreds of biological activity types for any drug-like compound. The prediction is based on the analysis of structure-activity relationships of the training set including more...