| Quantifying the Effects of Hydrogen Bonding on Nitrile Frequencies in GFP: Beyond Solvent Exposure JT First, JD Slocum, LJ Webb The Journal of Physical Chemistry B 122 (26), 6733-6743, 2018 | 39 | 2018 |
| Quantitative Measurement of Intrinsic GTP Hydrolysis for Carcinogenic Glutamine 61 Mutants in H-Ras ET Novelli, JT First, LJ Webb Biochemistry 57 (44), 6356-6366, 2018 | 35 | 2018 |
| Orthogonal Electric Field Measurements near the Green Fluorescent Protein Fluorophore through Stark Effect Spectroscopy and pKa Shifts Provide a Unique … JD Slocum, JT First, LJ Webb The Journal of Physical Chemistry B 121 (28), 6799-6812, 2017 | 21 | 2017 |
| Noisy intermediate-scale quantum simulation of the one-dimensional wave equation L Wright, C Mc Keever, JT First, R Johnston, J Tillay, S Chaney, ... Physical Review Research 6 (4), 043169, 2024 | 14* | 2024 |
| Beyond pKa: Experiments and Simulations of Nitrile Vibrational Probes in Staphylococcal Nuclease Show the Importance of Local Interactions JT First, ET Novelli, LJ Webb The Journal of Physical Chemistry B 124 (16), 3387-3399, 2020 | 14 | 2020 |
| Agreement between Experimental and Simulated Circular Dichroic Spectra of a Positively Charged Peptide in Aqueous Solution and on Self-Assembled Monolayers JT First, LJ Webb The Journal of Physical Chemistry B 123 (21), 4512-4526, 2019 | 14 | 2019 |
| Quantifying the Extent of Hydration of a Surface-Bound Peptide Using Neutron Reflectometry WA Fies, JT First, JW Dugger, M Doucet, JF Browning, LJ Webb Langmuir 36 (2), 637-649, 2019 | 8 | 2019 |
| A dual-cutoff machine-learned potential for condensed organic systems obtained via uncertainty-guided active learning L Kahle, B Minisini, T Bui, JT First, C Buda, T Goldman, E Wimmer Physical Chemistry Chemical Physics 26 (34), 22665-22680, 2024 | 1 | 2024 |
| Federated Learning Test for Collaborative Machine Learning B Chang, Ç Turhan, M Esteva, M Prodanović, JT First, Y Ning, Y Zapata, ... Society of Core Analysts Annual Symposium Proceedings 2024, 1036, 2024 | | 2024 |
| Molecular Simulations of Noncovalent Interactions in Complex Biological Systems JT First The University of Texas at Austin, 2019 | | 2019 |
