Dorobek naukowy

1. Kuleta P., Pietras R., Andrys-Olek J., Wójcik-Augustyn A., Osyczka A. (2023) Probing molecular interactions of semiquinone radicals at quinone reduction sites of cytochrome bc₁ by X-band HYSCORE EPR spectroscopy and quantum mechanical calculations, Phys. Chem. Chem Psych., 25: 21935
2. Wójcik-Augustyn A., Johansson A. J., Borowski T. (2021) Reaction mechanism catalyzed by the dissimilatory adenosine 5′-phosphosulfate reductase. Adenosine 5′-monophosphate inhibitor and key role of arginine 317 in switching t he course of catalysis . Biochimica et Biophysica Acta (BBA) - Bioenergetics 1862 (1), 148333
3. Bratek M., Wójcik-Augustyn A., Kania A., Majta J., Murzyn K. (2020) Condensed phase properties of n-pentadecane emerging fromapplication of biomolecular force fields. Acta  Biochimica Polonica 67 (3), 309-318
4. Pintscher S., Wójcik-Augustyn A., Sarewicz M., Osyczka A. (2020) Charge polarization imposed by the binding site facilitates enzymatic redox reactions of quinone . Biochimica et Biophysica Acta (BBA) - Bioenergetics 1861 (8), 148216\
5. Wójcik-Augustyn A., Johansson A. J., Borowski T. (2019) Mechanism of Sulfate Activation Catalyzed by ATP Sulfurylase - Magnesium Inhibits the Activity. Computational and Structural Biotechnology Journal 17, 770-784
6. Rugor A., Wójcik-Augustyn A., Niedzialkowska E., Mordalski S., Staron J., Bojarski A., Szaleniec M. (2017) Reaction mechanism of sterol hydroxylation by steroid C25 dehydrogenase - Homology model, reactivity and isoenzymatic diversity. Journal of Inorganic Biochemistry 173, 28-43
7. Wójcik A., Radoń M., Borowski T. (2016) Mechanism of O-2 Activation by alpha-Ketoglutarate Dependent Oxygenases Revisited. A Quantum Chemical Study. Journal of Physical Chemistry A 120(8), 1261-1274
8. Wójcik A., Broclawik E., Siegbahn P. E. M., Lundberg M., Moran G., Borowski T. (2014) Role of Substrate Positioning in the Catalytic Reaction of 4-Hydroxyphenylpyruvate Dioxygenase-A QM/MM Study. Journal of the American Chemical Society 136(41), 14472-14485
9. Dudzik A., Kozik B., Tataruch M., Wójcik A., Knack D., Borowski T., Heider J., Witko M., Szaleniec M. (2013) The reaction mechanism of chiral hydroxylation of p-OH and p-NH2 substituted compounds by ethylbenzene dehydrogenase. Canadian Journal of Chemistry-Revue Canadienne de Chimie 91(9), 775-786
10. Wójcik A., Broclawik E., Siegbahn P. E. M., Borowski T. (2012) Mechanism of Benzylic Hydroxylation by 4-Hydroxymandelate Synthase. A Computational Study. Biochemistry 51(47), 9570-9580
11. Borowski T., Wójcik A., Miłaczewska A., Georgiev V., Blomberg M. R. A., Siegbahn P. E. M. (2012) The alkenyl migration mechanism catalyzed by extradiol dioxygenases: a hybrid DFT study. Journal of Biological Inorganic Chemistry 17(6), 881-890
12. Wójcik A., Borowski T., Broclawik E. (2011) The mechanism of the reaction of intradiol dioxygenase with hydroperoxy probe A DFT study. Catalysis Today 169(1), 207-216