Prediction models for molecular activity and protein binding

Details Prediction models for molecular activity and protein binding Prediction models for molecular activity and protein binding

G - Physics

06

F

G06F 19/00 (2006.01) G01N 33/68 (2006.01)

Patent

CA 2455916

A method predicts at least one property of a candidate molecule. A set of reference molecules is classified as either possessing at least one property. A subset of the molecules is selected from which a plurality of marker molecules is chosen. The marker molecules are used to predict whether the candidate molecule possesses at least one property.

L'invention concerne un procédé permettant de prévoir au moins une propriété liée à une molécule d'intérêt. Ce procédé consiste à classer un ensemble de molécules de référence en fonction de la présence ou de l'absence d'au moins une propriété, à sélectionner un sous-ensemble de ces molécules, à choisir une pluralité de molécules de marquage dans ce sous-ensemble et à utiliser ces molécules de marquage pour déterminer si la molécule d'intérêt possède au moins une propriété.

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