530970 Using Machine Learning to Recommend Reaction Conditions and Quantifying Similarity of Catalysts, Solvents, and Reagents

Hanyu Gao1, Thomas Struble2, Connor W. Coley1, William H. Green1 and Klavs F. Jensen1, (1)Department of Chemical Engineering, Massachusetts Institute of Technology, Cambridge, MA, (2)Chemical Engineering, MIT, Cambridge, MA
See more of this Session: Data Analytics for Process Prediction
See more of this Group/Topical: Pharmaceutical Discovery, Development and Manufacturing Forum