Three-dimensional organization of promyelocytic leukemia nuclear bodies M Lang, T Jegou, I Chung, K Richter, S Münch, A Udvarhelyi, C Cremer, ... Journal of cell science 123 (3), 392-400, 2010 | 156 | 2010 |
Evolution of a new enzyme for carbon disulphide conversion by an acidothermophilic archaeon MJ Smeulders, TRM Barends, A Pol, A Scherer, MH Zandvoort, ... Nature 478 (7369), 412-416, 2011 | 96 | 2011 |
High accuracy quantum-chemistry-based calculation and blind prediction of macroscopic pKa values in the context of the SAMPL6 challenge P Pracht, R Wilcken, A Udvarhelyi, S Rodde, S Grimme Journal of Computer-Aided Molecular Design 32, 1139-1149, 2018 | 55 | 2018 |
Glutamine rotamers in BLUF photoreceptors: A mechanistic reappraisal A Udvarhelyi, T Domratcheva The Journal of Physical Chemistry B 117 (10), 2888-2897, 2013 | 55 | 2013 |
Photoreaction in BLUF Receptors: Proton‐coupled Electron Transfer in the Flavin‐Gln‐Tyr System† A Udvarhelyi, T Domratcheva Photochemistry and photobiology 87 (3), 554-563, 2011 | 51 | 2011 |
Onset of the Electronic Absorption Spectra of Isolated and π-Stacked Oligomers of 5,6-Dihydroxyindole: An Ab Initio Study of the Building Blocks of Eumelanin D Tuna, A Udvarhelyi, AL Sobolewski, W Domcke, T Domratcheva The Journal of Physical Chemistry B 120 (14), 3493-3502, 2016 | 46 | 2016 |
Characterization of elements involved in allosteric light regulation of phosphodiesterase activity by comparison of different functional BlrP1 states A Winkler, A Udvarhelyi, E Hartmann, J Reinstein, A Menzel, ... Journal of Molecular Biology 426 (4), 853-868, 2014 | 42 | 2014 |
Benchmarking different QM levels for usage with COSMO-RS J Reinisch, M Diedenhofen, R Wilcken, A Udvarhelyi, A Glöß Journal of Chemical Information and Modeling 59 (11), 4806-4813, 2019 | 28 | 2019 |
Role of the molecular environment in flavoprotein color and redox tuning: QM cluster versus QM/MM modeling A Udvarhelyi, M Olivucci, T Domratcheva Journal of Chemical Theory and Computation 11 (8), 3878-3894, 2015 | 27 | 2015 |
Structural details of light activation of the LOV2-based photoswitch PA-Rac1 A Winkler, TRM Barends, A Udvarhelyi, D Lenherr-Frey, L Lomb, ... ACS chemical biology 10 (2), 502-509, 2015 | 27 | 2015 |
Toward a scalable synthesis and process for EMA401, Part III: Using an engineered phenylalanine ammonia lyase enzyme to synthesize a non-natural phenylalanine derivative LA Hardegger, P Beney, D Bixel, C Fleury, F Gao, AGG Perrenoud, X Gu, ... Organic Process Research & Development 24 (9), 1763-1771, 2020 | 18 | 2020 |
ReSCoSS: a flexible quantum chemistry workflow identifying relevant solution conformers of drug-like molecules A Udvarhelyi, S Rodde, R Wilcken Journal of computer-aided molecular design 35, 399-415, 2021 | 15 | 2021 |
Computational spectroscopy, dynamics, and photochemistry of photosensory flavoproteins T Domratcheva, A Udvarhelyi, ARM Shahi Flavins and Flavoproteins: Methods and Protocols, 191-228, 2014 | 7 | 2014 |
Thermal Safety and Structure-Related Reactivity Investigation of Five-Membered Cyclic Sulfamidates T Ferrari, C Blum, L Amini-Rentsch, P Brodard, M Dabros, P Hoehn, ... Organic Process Research & Development 26 (9), 2614-2623, 2022 | 2 | 2022 |
Energy partitioning of pharmaceutical co-crystal structures B Dittrich, LE Connor, D Werthmueller, N Sykes, A Udvarhelyi CrystEngComm 25 (7), 1101-1115, 2023 | 1 | 2023 |
Small-and wide-angle X-ray scattering experiments on blue light photoreceptors A Udvarhelyi Ruprecht-Karls-Universität Heidelberg Heidelberg, 2009 | 1 | 2009 |
MS32-P21 Towards understanding solvent-mediated conformational polymorphism A Udvarhelyi, G Woollam Foundations of Crystallography 72, s366, 2016 | | 2016 |
Molecular mechanism of light activation in the blue-light photoreceptor BLUF A Udvarhelyi | | 2014 |