Accurate and Efficient Structure Elucidation from Routine One-Dimensional NMR Spectra Using Multitask Machine Learning

• Frank Hu,
• Michael S. Chen,
• Grant M. Rotskoff,
• Matthew W. Kanan,
• Thomas E. Markland

Affiliations

Frank Hu

Department of Chemistry, Stanford University, Stanford, California, United States

Michael S. Chen

Simons Center for Computational Physical Chemistry, Department of Chemistry, New York University, New York, New York, United States

Grant M. Rotskoff

Department of Chemistry, Stanford University, Stanford, California, United States

Matthew W. Kanan

Department of Chemistry, Stanford University, Stanford, California, United States

Thomas E. Markland

Department of Chemistry, Stanford University, Stanford, California, United States