Interactive Discriminative Mining of Chemical Fragments

Abstract

Structural activity prediction is one of the most important tasks in chemoinformatics. The goal is to predict a property of interest given structural data on a set of small compounds or drugs. Ideally, systems that address this task should not just be accurate, they should also be able to identify an interpretable discriminative structure which describes… (More)
DOI: 10.1007/978-3-642-21295-6_10

Topics

Figures and Tables

Sorry, we couldn't extract any figures or tables for this paper.

Slides referencing similar topics