| Importance of engineered and learned molecular representations in predicting organic reactivity, selectivity, and chemical properties LC Gallegos, G Luchini, PC St. John, S Kim, RS Paton Accounts of Chemical Research 54 (4), 827-836, 2021 | 74 | 2021 |
| Real-time prediction of 1 H and 13 C chemical shifts with DFT accuracy using a 3D graph neural network Y Guan, SVS Sowndarya, LC Gallegos, PCS John, RS Paton Chemical Science 12 (36), 12012-12026, 2021 | 64 | 2021 |
| Umpolung Synthesis of Pyridyl Ethers by BiV‐Mediated O‐Arylation of Pyridones K Ruffell, LC Gallegos, KB Ling, RS Paton, LT Ball Angewandte Chemie International Edition 61 (51), e202212873, 2022 | 11 | 2022 |
| Site-selective photocatalytic functionalization of peptides and proteins at selenocysteine LJ Dowman, SS Kulkarni, JV Alegre-Requena, AM Giltrap, AR Norman, ... Nature Communications 13 (1), 6885, 2022 | 11 | 2022 |
| Mechanistic Studies Yield Improved Protocols for Base-Catalyzed Anti-Markovnikov Alcohol Addition Reactions C Luo, JV Alegre-Requena, SJ Sujansky, SP Pajk, LC Gallegos, ... Journal of the American Chemical Society 144 (22), 9586-9596, 2022 | 7 | 2022 |
| Solvent design strategies from computation and statistical modeling L Gallegos, JVA Requena, R Paton ACS Fall National Meeting and Exposition Conference Location San Diego, CA, 2019 | | 2019 |
| Combining mechanistic and statistical models for predicting reaction outcomes in organic synthesis LC Gallegos, RS Paton, A McNally, A Rappé, A Hess Colorado State University. Libraries, 0 | | |
