Researchers
Grubišić, Sonja
Results 1-20 of 56
| Issue Date | Title | Author(s) | Type | Мp-cat. |
|---|---|---|---|---|
| 2026 | Chemically Accurate Prediction of CO2 Adsorption Thermodynamics in Metal-Organic Framework CALF-20: Complementary Ab Initio Modeling and Grand Canonical Monte Carlo Simulations | Sillar, Kaido; Grubisic, Sonja   ; Djordjevic, Ivana S ; Hochlaf, Majdi | Article | 21aM21a |
| 2025 | Tuning crystal packing and reactivity through electrostatc and dispersion interactions: The case of phenytoin and its derivatives | Đorđević, Ivana; Grubišić, Sonja ; Mitić, Dragana ; Popović, Dragan ; Trišović, Nemanja | Article | 23M23 |
| 2025 | Tuning crystal packing and reactivity through electrostatic and dispersion interactions: The case of phenytoin and its derivatives | Đorđević, Ivana S. ; Grubišić, Sonja ; Mitić, Dragana ; Popović, Dragan M. ; Trišović, Nemanja | Article | 23M23 |
| 2024 | Optimization of Non-Polarizable and Polarizable Force Fields and Their Application to Model Compounds | Grubišić, Sonja ; Đorđević, Ivana ; Popović, Dragan M. | Book parts | 13  MNO za hemiju (27.02.2024.)M13 |
| 2023 | Selective adsorption of sulphur dioxide and hydrogen sulphide by metal–organic frameworks | Grubišić, Sonja ; Dahmani, R.; Djordjević, Ivana; Sentić, Milica ; Hochlaf, M. | Article | 21M21 |
| 2022 | Analysis of the Ce(III) chloride, Ce(III) nitrate, and Ce(III) propionate as corrosion inhibitor of the aluminum alloys in NaCl solution | Radojković, Bojana ; Marunkić, Dunja ; Milošević, Milena ; Grubišić, Sonja ; Pejić, Jovanka ; Jegdić, Bore ; Marinković, Aleksandar | Article | 21M21 |
| 2022 | Editorial: Computational Methods for the Description of Intermolecular Interactions and Molecular Motion in Confining Environments | Reis, Heribert; Żuchowski, Piotr; Grubišić, Sonja | Contribution to periodical | 21M21 |
| 2021 | 3D-QSAR, molecular docking and in silico ADMET studies of propiophenone derivatives with anti-HIV-1 protease activity | Jovanović, Milan ; Turković, Nemanja; Ivković, Branka ; Vujić, Zorica ; Nikolić, Katarina ; Grubišić, Sonja | Article | 22M22 |
| 2021 | In silico design of a new Zn-triazole based metal-organic framework for CO2 and H2O adsorption | Dahmani, Rahma; Grubišić, Sonja ; Đorđević, Ivana ; Ben Yaghlane, Saida; Boughdiri, S.; Chambaud, Gilberte; Hochlaf, Majdi | Article | 21M21 |
| 2020 | Synthesis, Characterization, Catalytic Activity, and DFT Calculations of Zn(II) Hydrazone Complexes | Adejumo, Temiloluwa T.; Tzouras, Nikolaos V.; Zorba, Leandros P.; Radanović, Dušanka ; Pevec, Andrej; Grubišić, Sonja ; Mitić, Dragana ; Anđelković, Katarina ; Vougioukalakis, Georgios C.; Čobeljić, Božidar ;
Turel, Iztok;
| Article | 21M21 |
| 2019 | Half-sandwich ruthenium(II)-arene complexes: synthesis, spectroscopic studies, biological properties, and molecular modeling | Nikolić, Stefan ; Grgurić-Šipka, Sanja ; Đorđević, Ivana ; Dahmani, Rahma; Dekanski, Dragana ; Vidičević, Sašenka ; Tošić, Jelena ; Mitić, Dragana ; Grubišić, Sonja | Article | 22M22 |
| 2019 | Complexes of Zn(II)–Triazoles with CO2 and H2O: Structures, Energetics, and Applications | Dahmani, Rahma; Grubišić, Sonja ; Yaghlane, Saida Ben; Boughdiri, Salima; Hochlaf, Majdi | Article | 22M22 |
| 2018 | Parameterization and validation of an accurate force-field for molecular dynamics simulations of organic and biomolecular systems | Grubišić, Sonja M. | Conference Paper | Mp. category will be shown later |
| 2018 | GCMC simulations of gas adsorption by metal and metal organic framework materials | Grubišić, Sonja M. | Conference Paper | Mp. category will be shown later |
| 2018 | Crystal structures and DFT calculations of mixed chloride-azide zinc(II) and chloride-isocyanate cadmium(II) complexes with the condensation product of 2-quinolinecarboxaldehyde and Girard's T reagent | Anđelković, Katarina K. ; Pevec, Andrej; Grubišić, Sonja ; Turel, Iztok; Čobeljić, Božidar ; Milenković, Milica R. ; Keskić, Tanja ; Radanović, Dušanka D. | Article | 22M22 |
| 2018 | Selenazolyl-hydrazones as Novel Selective MAO Inhibitors With Antiproliferative and Antioxidant Activities: Experimental and In-silico Studies | Elshaflu, Hana; Todorović, Tamara ; Nikolić, Milan ; Lolić, Aleksandar ; Višnjevac, Aleksandar; Hagenow, Stefanie; Padrón, José M.; Garcia-Sosa, Alfonso T.; Đorđević, Ivana S. ; Grubišić, Sonja ;
Stark, Holger; Filipović, Nenad R.
; | Article | 21M21 |
| 2018 | Crystal structures, magnetic properties and DFT study of cobalt(II) azido complexes with the condensation product of 2-quinolinecarboxaldehyde and Girard's T reagent | Romanović, Mima ; Milenković, Milica R. ; Pevec, Andrej; Turel, Iztok; Spasojević, Vojislav ; Grubišić, Sonja ; Radanović, Dušanka D. ; Anđelković, Katarina K. ; Čobeljić, Božidar | Article | 22M22 |
| 2017 | Co(III) complexes of (1,3-selenazol-2-yl)hydrazones and their sulphur analogues | Filipović, Nenad R. ; Elshaflu, Hana; Grubišić, Sonja ; Jovanović, Ljiljana S.; Rodić, Marko ; Novaković, Irena T. ; Malešević, Aleksandar ; Đorđević, Ivana S. ; Li, Haidong; Šojić, Nešo;
Marinković, Aleksandar
; Todorović, Tamara ; | Article | 21aM21a |
| 2017 | Theoretical study of Co(III) complexes with selenazoles and thiazoles | Đorđević, Ivana S. ; Grubišić, Sonja M. | Conference Paper | Mp. category will be shown later |
| 2017 | Assessing the dispersive and electrostatic components of the selenium-aromatic interaction energy by DFT | Senćanski, Milan ; Đorđević, Ivana ; Grubišić, Sonja | Article | 22M22 |