Hof Marieke AJ,Sewdihal Jeffrey,Stepanovic Stepan M,Hermans Jos H,Horvatovich Peter,Olinga Peter,Klont Frank (2026) Inter-species variability in 4,4′-methylenedianiline metabolism: insights from human and rat precision-cut liver slices, REGULATORY TOXICOLOGY AND PHARMACOLOGY, vol. 166, br. , str. - (Article) Hof Marieke AJ,De Haan Hessel,Stepanovic Stepan M,Bakker Stephan JL,Hak Eelko,Hopfgartner Gerard,Klont Frank (2025) Pharmacometabolomics Study of Sulfamethoxazole and Trimethoprim in Kidney Transplant Recipients: Real-World Metabolism and Urinary Excretion, METABOLITES, vol. 15, br. 7, str. - (Article) Stepanovic Stepan M,Ekmekciu Lysi,Alghanem Bandar,Hopfgartner Gerard (2024) Insights into modifiers effects in differential mobility spectrometry: A data science approach for metabolomics and peptidomics, JOURNAL OF MASS SPECTROMETRY, vol. 59, br. 6, str. - (Article) Stepanovic Stepan M,Hopfgartner Gerard (2023) Predicting Preferences for Adduct Formation in Electrospray Ionization: The Case Study of Succinic Acid, JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY, vol. 34, br. 4, str. 562-569 (Article) Stepanovic Stepan M,Lai Rui,Elstner Marcus,Gruden Maja A,Garcia-Fernandez Pablo,Cui Qiang (2020) Improvement of d-d interactions in density functional tight binding for transition metal ions with a ligand field model: assessment of a DFTB3+U model on nickel coordination compounds, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, vol. 22, br. 46, str. 27084-27095 (Article) Vlahovic Filip Z,Gruden Maja A,Stepanovic Stepan M,Swart Marcel (2020) Density functional approximations for consistent spin and oxidation states of oxoiron complexes, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, vol. 120, br. 5, str. - (Article) Vlahovic Filip Z,Gruden Maja A,Stepanovic Stepan M,Swart Marcel (2020) Density functional approximations for consistent spin and oxidation states of oxoiron complexes, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, vol. 120, br. 5, str. - (Article) Steen Jorn D,Stepanovic Stepan M,Parvizian Mahsa,De Boer Johannes W,Hage Ronald,Chen Juan,Swart Marcel,Gruden Maja A,Browne Wesley R (2019) Lewis versus Bronsted Acid Activation of a Mn(IV) Catalyst for Alkene Oxidation, INORGANIC CHEMISTRY, vol. 58, br. 21, str. 14924-14930 (Article) Stepanovic Stepan M,Zlatar Matija S,Swart Marcel,Gruden Maja A (2019) The Irony of Manganocene: An Interplay between the Jahn-Teller Effect and Close-Lying Electronic and Spin States, JOURNAL OF CHEMICAL INFORMATION AND MODELING, vol. 59, br. 5, str. 1806-1810 (Article) Cobeljic Bozidar R,Pevec Andrej,Stepanovic Stepan M,Milenkovic Milica R,Turel Iztok,Gruden Maja A,Radanovic Dusanka D,Andjelkovic Katarina K (2018) Structural diversity of isothiocyanato Cd(II) and Zn(II) Girard's T hydrazone complexes in solution and solid state: effect of H-bonding on coordination number and supramolecular assembly of Cd(II) complex in solid state, STRUCTURAL CHEMISTRY, vol. 29, br. 6, str. 1797-1806 (Article) Chen Juan,Unjaroen Duenpen,Stepanovic Stepan M,van Dam Annie,Gruden Maja A,Browne Wesley R (2018) Selective Photo-Induced Oxidation with O-2 of a Non-Heme Iron(III) Complex to a Bis(imine-pyridyl)iron(II) Complex, INORGANIC CHEMISTRY, vol. 57, br. 8, str. 4510-4515 (Article) Chen Juan,Stepanovic Stepan M,Draksharapu Apparao,Gruden Maja A,Browne Wesley R (2018) A Non-Heme Iron Photocatalyst for Light-Driven Aerobic Oxidation of Methanol, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, vol. 57, br. 12, str. 3207-3211 (Article) Stepanovic Stepan M,Angelone D,Gruden Maja A,Swart Marcel (2017) The role of spin states in the catalytic mechanism of the intra- and extradiol cleavage of catechols by O-2, ORGANIC & BIOMOLECULAR CHEMISTRY, vol. 15, br. 37, str. 7860-7868 (Article) Gruden Maja A,Andjelkovic Ljubica D,Jissy Akkarapattiakal Kuriappan,Stepanovic Stepan M,Zlatar Matija S,Cui Qiang,Elstner Marcus (2017) Benchmarking density functional tight binding models for barrier heights and reaction energetics of organic molecules, JOURNAL OF COMPUTATIONAL CHEMISTRY, vol. 38, br. 25, str. 2171-2185 (Article) Ajdacic Vladimir D,Stepanovic Stepan M,Zlatovic Mario V,Gruden Maja A,Opsenica Igor M (2016) Decarbonylative Dibromination of 5-Phenylthiophene-2-carbaldehyde with Bromine, SYNTHESIS-STUTTGART, vol. 48, br. 24, str. 4423-4430 (Article) Andjelkovic Ljubica D,Stepanovic Stepan M,Vlahovic Filip Z,Zlatar Matija S,Gruden Maja A (2016) Resolving the origin of the multimode Jahn-Teller effect in metallophthalocyanines, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, vol. 18, br. 42, str. 29122-29130 (Article) Adhikary Jaydeep,Chakraborty Aratrika,Dasgupta Sanchari,Chattopadhyay Shyamal Kumar,Kruszynski Rafal,Trzesowska-Kruszynska Agata,Stepanovic Stepan M,Gruden-Pavlovic Maja A,Swart Marcel,Das Debasis (2016) Unique mononuclear Mn-II complexes of an end-off compartmental Schiff base ligand: experimental and theoretical studies on their bio-relevant catalytic promiscuity, DALTON TRANSACTIONS, vol. 45, br. 31, str. 12409-12422 (Article) Fitzpatrick AJ,Stepanovic Stepan M,Mueller-Bunz H,Gruden-Pavlovic Maja A,Garcia-Fernandez Pablo,Morgan GG (2016) Challenges in assignment of orbital populations in a high spin manganese(III) complex, DALTON TRANSACTIONS, vol. 45, br. 15, str. 6702-6708 (Article) Gruden Maja A,Stepanovic Stepan M,Swart Marcel (2015) Spin state relaxation of iron complexes: The case for OPBE and S12g, JOURNAL OF THE SERBIAN CHEMICAL SOCIETY, vol. 80, br. 11, str. 1399-+ (Article) Cobeljic Bozidar R,Pevec Andrej,Stepanovic Stepan M,Spasojevic Vojislav V,Milenkovic Milica R,Turel Iztok,Swart Marcel,Gruden-Pavlovic Maja A,Adaila Kawther,Andjelkovic Katarina K (2015) Experimental and theoretical investigation of octahedral and square-planar isothiocyanato complexes of Ni(II) with acylhydrazones of 2-(diphenylphosphino)benzaldehyde, POLYHEDRON, vol. 89, br. , str. 271-279 (Article) Peric Marko R,Garcia-Fuente Amador,Zlatar Matija S,Daul Claude,Stepanovic Stepan M,Garcia-Fernandez Pablo,Gruden-Pavlovic Maja A (2015) Magnetic Anisotropy in "Scorpionate" First-Row Transition-Metal Complexes: A Theoretical Investigation, CHEMISTRY-A EUROPEAN JOURNAL, vol. 21, br. 9, str. 3716-3726 (Article) Gruden-Pavlovic Maja A,Stepanovic Stepan M,Peric Marko R,Gueell M,Swart Marcel (2014) A density functional study of the spin state energetics of polypyrazolylborato complexes of first-row transition metals, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, vol. 16, br. 28, str. 14514-14522 (Article) Stepanovic Stepan M,Andjelkovic Ljubica D,Zlatar Matija S,Andjelkovic Katarina K,Gruden-Pavlovic Maja A,Swart Marcel (2013) Role of Spin State and Ligand Charge in Coordination Patterns in Complexes of 2,6-Diacetylpyridinebis(semioxamazide) with 3d-Block Metal Ions: A Density Functional Theory Study, INORGANIC CHEMISTRY, vol. 52, br. 23, str. 13415-13423 (Article)