| Deep learning study of tyrosine reveals that roaming can lead to photodamage J Westermayr, M Gastegger, D Vörös, L Panzenboeck, F Joerg, ... Nature Chemistry 14 (8), 914-919, 2022 | 43 | 2022 |
| Emulating proton transfer reactions in the pseudo-protic ionic liquid 1-methylimidazolium acetate R Jacobi, F Joerg, O Steinhauser, C Schröder Physical Chemistry Chemical Physics 24 (16), 9277-9285, 2022 | 12 | 2022 |
| Polarizable molecular dynamics simulations on the conductivity of pure 1-methylimidazolium acetate systems F Joerg, C Schröder Physical Chemistry Chemical Physics 24 (25), 15245-15254, 2022 | 9 | 2022 |
| Nuclear Overhauser spectroscopy in hyperpolarized water–chemical vs. magnetic exchange LM Epasto, P Honegger, K Che, F Kozak, F Jörg, C Schröder, D Kurzbach Chemical Communications 58 (83), 11661-11664, 2022 | 8 | 2022 |
| Protex—A Python utility for proton exchange in molecular dynamics simulations F Joerg, M Wieder, C Schröder Frontiers in Chemistry 11, 1140896, 2023 | 7 | 2023 |
| Updates to Protex for Simulating Proton Transfers in an Ionic Liquid M Gődény, F Joerg, MPP Kovar, C Schröder The Journal of Physical Chemistry B 128 (14), 3416-3426, 2024 | 2 | 2024 |
| Comparative analysis of dielectric spectra in protic ionic liquids: Experimental findings and computational molecular decomposition F Joerg, J Sutter, L van Dam, K Kanellopoulos, J Hunger, C Schröder Journal of Molecular Liquids 396, 123834, 2024 | 1 | 2024 |
| Roaming leads to amino acid photodamage: A deep learning study of tyrosine J Westermayr, M Gastegger, D Vörös, L Panzenboeck, F Joerg, ... arXiv preprint arXiv:2108.04373, 2021 | | 2021 |
| Molecular Dynamics Simulations of Proton Transfer in Ionic Liquids M Gődény, F Joerg, N Kovács, MPP Kovar, M Parteder, C Schröder Book of Abstracts, 0 | | |
| Nuclear Overhauser spectroscopy in hyperpolarized water-chemical vs. magnetic exchange Supplementary Information LM Epasto, P Honegger, K Che, F Kozak, F Jörg, C Schröderc, ... | | |
