| Projector-based embedding eliminates density functional dependence for QM/MM calculations of reactions in enzymes and solution KE Ranaghan, D Shchepanovska, SJ Bennie, N Lawan, SJ Macrae, ... Journal of Chemical Information and Modeling 59 (5), 2063-2078, 2019 | 34 | 2019 |
| Calculating photoabsorption cross-sections for atmospheric volatile organic compounds A Prlj, E Marsili, L Hutton, D Hollas, D Shchepanovska, DR Glowacki, ... ACS Earth and Space Chemistry 6 (1), 207-217, 2021 | 22 | 2021 |
| Solvent-dependent photochemical dynamics of a phenoxazine-based photoredox catalyst M Sneha, L Lewis-Borrell, D Shchepanovska, A Bhattacherjee, J Tyler, ... Zeitschrift für Physikalische Chemie 234 (7-9), 1475-1494, 2020 | 12 | 2020 |
| Nonadiabatic kinetics in the intermediate coupling regime: Comparing molecular dynamics to an energy-grained master equation D Shchepanovska, RJ Shannon, BFE Curchod, DR Glowacki The Journal of Physical Chemistry A 125 (16), 3473-3488, 2021 | 7 | 2021 |
| Ab initio methods for atmospheric photochemistry D Shchepanovska University of Bristol, 2021 | | 2021 |
| Supporting information for: Solvent-dependent photochemical dynamics of a phenoxazine-based photoredox catalyst M Sneha, L Lewis-Borrell, D Shchepanovska, A Bhattacherjee, J Tyler, ... | | |
