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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 |
| 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 |
| 24-Oct-2017 | Alkene-assisted cis-to-trans isomerization of non-conjugated polyunsaturated alkenes | Smarun, A V; Duzhin, F; Petković, Milena ; Vidović, D |
| 1-Jan-2007 | Are the program packages for molecular structure calculations really black boxes? | Mraković, Ana; Drvendžija, Milica; Samolov, Aleksandra; Petković, Milena ; Perić, Miljenko |
| 5-Oct-2023 | Base Stacking and Sugar Orientations Contribute to Chiral Recognition of Single-Walled Carbon Nanotubes by Short ssDNAs | Chakraborty, Sayantani; Ebarguen, Enrique; Chacon, Kevin E.; Petković, Milena ; Vuković, Lela |
| 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 |
| 28-Jul-2016 | Bis(carbodicarbene)phosphenium trication: the case against hypervalency | Đorđević, Nemanja; Ganguly, Rakesh; Petković, Milena ; Vidović, Dragoslav |
| 27-Apr-2022 | Carbodiphosphorane-Stabilized Parent Dioxophosphorane: A Valuable Synthetic HO2P Source | Liu, Zhizhou; McKay, Alasdair I; Zhao, Lili; Forsyth, Craig M; Jevtović, Violeta; Petković, Milena ; Frenking, Gernot; Vidović, Dragoslav |
| 1-Jan-2004 | Cascaded energy redistribution upon O-H stretch excitation in an intramolecular hydrogen bonded system | Heyne, K.; Nibbering, E. T.J.; Elsaesser, T.; Petković, Milena ; Kühn, O. |
| 1-Dec-2004 | Cascaded energy redistribution upon O-H stretching excitation in an intramolecular hydrogen bond | Heyne, Karsten; Petković, Milena ; Nibbering, Erik T.J.; Kühn, Oliver; Elsaesser, Thomas |
| 5-Jan-2016 | Control of a photoswitching chelator by metal ions: DFT, NBO, and QTAIM analysis | Dimić, Dušan ; Petković, Milena |
| 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-Sep-2022 | Decomposition of Dimethoate and Omethoate in Aqueous Solutions — Half-Life, Eco-Neurotoxicity Benchmarking, and Mechanism of Hydrolysis | Anićijević, Vladan J.; Petković, Milena ; Pašti, Igor ; Lazarević-Pašti, Tamara D. |
| 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 |
| 4-Dec-2017 | E-H (E = B, Si, C) Bond Activation by Tuning Structural and Electronic Properties of Phosphenium Cations | Đorđević, Nemanja; Ganguly, Rakesh; Petković, Milena ; Vidović, Dragoslav |
