Method for producing chemical libraries enhanced with...

Details Method for producing chemical libraries enhanced with... Method for producing chemical libraries enhanced with...

G - Physics

01

N

G01N 33/48 (2006.01) G01N 33/50 (2006.01) G01N 33/542 (2006.01) G06F 19/00 (2006.01)

Patent

CA 2469170

Methods and compositions for enhancing chemical libraries with biologically active molecules are taught. Relevant physicochemical descriptors that correlate with biological activity are calculated and selected. Database descriptors are identified using the physicochemical descriptors and an electronic database can be formed.

L'invention concerne des procédés et des compositions destinés à améliorer des bibliothèques chimiques à molécules bioactives. Des descripteurs physico-chimiques correspondants qui sont mis en corrélation avec l'activité biologique sont calculés et sélectionnés. Des descripteurs de base de données sont identifiés au moyen de ces descripteurs physico-chimiques et une base de données électronique peut être formée.

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