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Using Conformal Prediction to Prioritize Compound Synthesis in Drug Discovery
International Symposium on Conformal and Probabilistic Prediction with Applications
The choice of how much money and resources to spend to understand certain problems is of high interest in many areas. This work illustrates how computational models can be more tightly coupled with experiments to generate decision data at lower cost without reducing the quality of the decision. Several different strategies are explored to illustrate the trade off between lowering costs and quality in decisions. AUC is used as a performance metric and the number of objects that can be learntdblp:conf/copa/AhlbergWBLLNJEH17 fatcat:sizbj2mqyjgthlgqme27vhzami