| Issue Date | Title | Author(s) |
| 1 | 16-Feb-2025 | Perturbational and Variational Energy Decomposition Analysis on Hydrogen Bonds of Coordinated Glycine and Water Molecule | Zrilić, Sonja S; Ninković, Dragan B; Etinski, Mihajlo ; Zarić, Snežana D |
| 2 | 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. |
| 3 | 23-Aug-2023 | Fractal nature of benzene stacking interactions | Jovanović, Nenad; Etinski, Mihajlo ; Stanković, Ivana M |
| 4 | 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 |
| 5 | 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 |
| 6 | 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. |
| 7 | Oct-2022 | Formation of Cyclobutane Dimers from the Solvated Uracil Stacks | Milovanović, Branislav ; Novak, Jurica; Etinski, Mihajlo ; Domcke, Wolfgang; Došlić, Nađa |
| 8 | 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 |
| 9 | 22-Jun-2022 | On the propensity of formation of cyclobutane dimers in face-to-face and face-to-back uracil stacks in solution | Milovanović, Branislav ; Novak, Jurica; Etinski, Mihajlo ; Domcke, Wolfgang; Došlić, Nađa |
| 10 | Jun-2022 | Al3+ Cation Interaction with Pristine and Defective Graphene Using Microsolvated Cluster Model: DFT Study | Milovanović, Branislav ; Vujković, Milica ; Etinski, Mihajlo |
| 11 | 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 |
| 12 | 9-Feb-2022 | Proton leap: shuttling of protons onto benzonitrile | Pavković, Nemanja; Milovanović, Branislav ; Stanojević, Ana; Etinski, Mihajlo ; Petković, Milena |
| 13 | Dec-2021 | Significant Modulation of Charge-transfer States Properties in the Biological Assembly of the d(TG4T) Sequence in Crystal Form | Milovanović, Branislav ; Petković, Milena ; Etinski, Mihajlo |
| 14 | 4-Nov-2021 | Water-Mediated Interactions Enhance Alkaline Earth Cation Chelation in Neighboring Cavities of a Cytosine Quartet in the DNA Quadruplex | Milovanović, Branislav ; Petković, Milena ; Popov, Igor; Etinski, Mihajlo |
| 15 | 6-Aug-2021 | Self-assembly of rylene-decorated guanine ribbons on graphene surface for optoelectronic applications: a theoretical study | Milovanović, Branislav ; Etinski, Mihajlo ; Popov, Igor |
| 16 | 4-Feb-2021 | Simulation of UV absorption spectra and relaxation dynamics of uracil and uracil-water clusters | Milovanović, Branislav ; Novak, Jurica; Etinski, Mihajlo ; Domcke, Wolfgang; Došlić, Nađa |
| 17 | 15-Jan-2021 | Polyaniline as a charge storage material in an aqueous aluminum-based electrolyte: Can aluminum ions play the role of protons? | Vujković, Milica ; Etinski, Mihajlo ; Vasić, Borislav; Kuzmanović, Bojana; Bajuk-Bogdanović, Danica ; Dominko, Robert; Mentus, Slavko |
| 18 | 6-Jan-2021 | The significance of the metal cation in guanine-quartet - metalloporphyrin complexes | Stanojević, Ana; Milovanović, Branislav ; Stanković, Ivana; Etinski, Mihajlo ; Petković, Milena |
| 19 | 8-Oct-2020 | Modulating Excited Charge-Transfer States of G-Quartet Self-Assemblies by Earth Alkaline Cations and Hydration | Milovanović, Branislav ; Stanković, Ivana M; Petković, Milena ; Etinski, Mihajlo |
| 20 | 20-May-2020 | Unraveling the mechanism of biomimetic hydrogen fuel production - a first principles molecular dynamics study | Puthenkalathil, Rakesh C; Etinski, Mihajlo ; Ensing, Bernd |
| 21 | 16-Apr-2020 | Intriguing Intermolecular Interplay in Guanine Quartet Complexes with Alkali and Alkaline Earth Cations | Milovanović, Branislav ; Stanojević, Ana; Etinski, Mihajlo ; Petković, Milena |
| 22 | 1-Jan-2020 | Properties of the excited electronic states of guanine quartet complexes with alkali metal cations | Milovanović, Branislav ; Petković, Milena ; Etinski, Mihajlo |
| 23 | 1-Jan-2020 | A DFT study of structure and electrochemical properties of diiron-hydrogenase models with benzenedithiolato and benzenediselenato ligands | Etinski, Mihajlo ; Stanković, Ivana M.; Puthenkalathil, Rakesh C.; Ensing, Bernd |
| 24 | Jan-2020 | Alkali Metal Cations Impact on the Excited States Properties of the Guanine Quartet | Milovanović, Branislav ; Petković, Milena ; Etinski, Mihajlo |
| 25 | Dec-2019 | Tuning Charge Transfer States in the G-octet-metal Ion Complexes for the Potential Nanotechnological Applications | Milovanović, Branislav ; Stanković, Ivana; Petković, Milena ; Etinski, Mihajlo |
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