Showing results 1 to 20 of 40
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| Issue Date | Title | Author(s) |
| Jun-2018 | Ab initio Molecular Dynamics Insights on How Dopamine Disarms Hydroxyl Radical | Milovanović, Branislav ; Popara Milana; Petković, Milena ; Etinski, Mihajlo |
| Jun-2022 | Al3+ Cation Interaction with Pristine and Defective Graphene Using Microsolvated Cluster Model: DFT Study | Milovanović, Branislav ; Vujković, Milica ; Etinski, Mihajlo |
| Jan-2020 | Alkali Metal Cations Impact on the Excited States Properties of the Guanine Quartet | Milovanović, Branislav ; Petković, Milena ; Etinski, Mihajlo |
| 15-Feb-2022 | Alkaline earth cations binding mode tailors excited-state charge transfer properties of guanine quadruplex: A TDDFT study | Milovanović, Branislav ; Petković, Milena ; Etinski, Mihajlo |
| 1-Jan-2023 | Binding symmetric porphyrins to the c-MYC promoter Pu24I G-quadruplex: toward more specific ligand recognition by flanking bases | Stanković, Ivana; Zrilić, Sonja; Milovanović, Branislav ; Stanojević, Ana; Petković, Milena ; Etinski, Mihajlo |
| 11-Nov-2024 | Crown Ether-Magnesium Ion Complexes: A Reliable Theoretical Estimation of Host-Guest Interaction and Binding Energies in a Solvent | Ćeranić, Katarina; Milovanović, Branislav ; Petković, Milena |
| Sep-2023 | Cyclic Crown Ether Traps for Alkali Ions: IQA Portrayed Reaction Pathways | Milovanović, Branislav ; Hercigonja, Marijana; Petković, Milena |
| 1-Jul-2023 | Decorated crown ethers as selective ion traps: Solvent's role in crown's preference towards a specific ion | Hercigonja, Marijana; Milovanović, Branislav ; Etinski, Mihajlo ; Petković, Milena |
| 6-Dec-2023 | Density functional theory study of crown ether-magnesium complexes: from a solvated ion to an ion trap | Ćeranić, Katarina; Milovanović, Branislav ; Petković, Milena |
| 27-Nov-2023 | Density Functional Theory Study of Crown Ether–Magnesium Complexes: From a Solvated Ion to an Ion Trap | Ćeranić, Katarina; Milovanović, Branislav ; Petković, Milena |
| Oct-2018 | Discussing Aqueous Uracil Aggregation with First Principle Molecular Dynamics Simulations | Milovanović, Branislav ; Petković, Milena ; Etinski, Mihajlo |
| 5-Nov-2019 | Elucidating Solvent Effects on Strong Intramolecular Hydrogen Bond: DFT-MD Study of Dibenzoylmethane in Methanol Solution | Milovanović, Branislav ; Stanković, Ivana M; Petković, Milena ; Etinski, Mihajlo |
| Oct-2022 | Formation of Cyclobutane Dimers from the Solvated Uracil Stacks | Milovanović, Branislav ; Novak, Jurica; Etinski, Mihajlo ; Domcke, Wolfgang; Došlić, Nađa |
| 1-Jan-2023 | Green corrosion inhibitors of steel based on peptides and their constituents: a combination of experimental and computational approach | Simović, Andjela; Stevanović, Sanja; Milovanović, Branislav ; Etinski, Mihajlo ; Bajat, Jelena B. |
| 1-Aug-2022 | High Al-ion storage of vine shoots-derived activated carbon: New concept for affordable and sustainable supercapacitors | Gezović, Aleksandra; Mišurović, Jana; Milovanović, Branislav ; Etinski, Mihajlo ; Krstić, Jugoslav; Grudić, Veselinka; Dominko, Robert; Mentus, Slavko ; Vujković, Milica |
| 1-Jan-2019 | Hydrogen transfer reaction: Bond formation and bond cleavage through the eyes of interacting quantum atoms | Milovanović, Branislav ; Etinski, Mihajlo ; Petković, Milena |
| Nov-2019 | Influence of the Metal Ions on the Charge Transfer States in the G-octet-metal Ion Complexes | Milovanović, Branislav ; Stanković, Ivana; Petković, Milena ; Etinski, Mihajlo |
| 15-Oct-2024 | Innovative hybrid and bifunctional rare earth complexes as corrosion inhibitors for AA2024 Alloy: Electrochemical and surface analysis enhanced by DFT/MD simulation | Simović, Anđela; Milovanović, Branislav ; Etinski, Mihajlo ; Matović, Luka; Bajat, Jelena B. |
| 16-Apr-2020 | Intriguing Intermolecular Interplay in Guanine Quartet Complexes with Alkali and Alkaline Earth Cations | Milovanović, Branislav ; Stanojević, Ana; Etinski, Mihajlo ; Petković, Milena |
| Sep-2018 | Ionization Energies of KnI (n = 2, 3) Clusters Theoretical and Experimental Evaluation | Milovanović, Branislav ; Milovanović, Milan ; Veličković, Suzana; Veljković, Filip; Perić-Grujić, Aleksandra; Jerosimić, Stanka |
