Anthony Rosales
Affiliations: | University of Notre Dame, Notre Dame, IN, United States |
Area:
Computational ChemistryGoogle:
"Anthony Rosales"Mean distance: (not calculated yet)
Parents
Sign in to add mentor| Paul M. Helquist | grad student | 2014-2019 | |
| Olaf G. Wiest | grad student | 2014-2019 |
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Publications
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| Purohit V, Steussy CN, Rosales AR, et al. (2024) pH-dependent reaction triggering in PmHMGR crystals for time-resolved crystallography. Biophysical Journal |
| Wahlers J, Rosales AR, Berkel N, et al. (2022) A Quantum-Guided Molecular Mechanics Force Field for the Ferrocene Scaffold. The Journal of Organic Chemistry. 87: 12334-12341 |
| Wahlers J, Maloney M, Salahi F, et al. (2021) Stereoselectivity Predictions for the Pd-Catalyzed 1,4-Conjugate Addition Using Quantum-Guided Molecular Mechanics. The Journal of Organic Chemistry |
| Rosales A, Ross SP, Helquist P, et al. (2020) Transition State Force Field for the Asymmetric Redox Relay Heck Reaction. Journal of the American Chemical Society |
| Rosales AR, Quinn TR, Wahlers J, et al. (2018) Application of Q2MM to predictions in stereoselective synthesis. Chemical Communications (Cambridge, England) |
| Rosales AR, Wahlers J, Limé E, et al. (2018) Rapid virtual screening of enantioselective catalysts using CatVS Nature Catalysis. 2: 41-45 |
| Ma J, Rosales AR, Huang X, et al. (2017) Visible-Light-Activated Asymmetric β-C-H Functionalization of Acceptor-Substituted Ketones with 1,2-Dicarbonyl Compounds. Journal of the American Chemical Society |
| Hansen E, Rosales AR, Tutkowski B, et al. (2016) Prediction of Stereochemistry using Q2MM. Accounts of Chemical Research |