Jul 2026
Underexplored Catalysts as General Structures: Application of Machine Learning Techniques for Reaction‐Specific Datasets
A bias‐aware machine learning workflow designed for small, uneven datasets to prioritize candidate general catalysts from limited historical data surfaced several high‐performing candidates, including a rarely studied imidazolidinone bearing a benzyl‐protected indole substituent.
Jiajing Li, Isaiah O. Betinol, Junshan Lai et al.
· Angewandte Chemie · 0 citations