Anthony R. Rosales
University of Notre Dame(US)
Publications by Year
Research Areas
Machine Learning in Materials Science, Surface Chemistry and Catalysis, Asymmetric Hydrogenation and Catalysis, Chemical Synthesis and Analysis, Advanced Chemical Physics Studies
Most-Cited Works
- → Rapid virtual screening of enantioselective catalysts using CatVS(2018)145 cited
- → Prediction of Stereochemistry using Q2MM(2016)115 cited
- → Visible-Light-Activated Asymmetric β-C–H Functionalization of Acceptor-Substituted Ketones with 1,2-Dicarbonyl Compounds(2017)113 cited
- → Application of Q2MM to predictions in stereoselective synthesis(2018)68 cited
- → Transition State Force Field for the Asymmetric Redox-Relay Heck Reaction(2020)27 cited
- → Stereoselectivity Predictions for the Pd-Catalyzed 1,4-Conjugate Addition Using Quantum-Guided Molecular Mechanics(2021)7 cited
- → A Quantum-Guided Molecular Mechanics Force Field for the Ferrocene Scaffold(2022)6 cited
- → Use of a Maggot Motility Index to Evaluate Survival of Therapeutic Larvae(2004)5 cited
- → pH-dependent reaction triggering in PmHMGR crystals for time-resolved crystallography(2024)4 cited
- Educator's Perceptions of the Impacts of School Violence on Caribbean Societies(2019)