| Issue Date | Title | Author(s) | Type | Мp-cat. |
| 2011 | DFT and MM description of the structure and magnetic properties of manganese complexes with X-phenylcyanamido bridging ligand | Perić, Marko ; Niketić, Svetozar R.; Zlatar, Matija ; Gruden-Pavlović, Maja ; Grubišić, Sonja  | Article | |
| 2011 | DFT i MM Analiza Strukture i Magnetnih Osobina Kompleksa Mangana(II) sa X-fenilcijanamidnim Mostnim Ligandom | Grubišić, Sonja ; Gruden-Pavlović, Maja ; Zlatar, Matija ; Perić, Marko  | Conference Paper | |
| 2010 | Consistent force field for metalloporphyrins | Anđelković, Ljubica ; Grubišić, Sonja ; Đorđević, Ivana ; Zlatar, Matija ; Niketić, Svetozar R.; Gruden-Pavlović, Maja  | Article | |
| 2010 | Monte Carlo simulations of argon adsorption in nanoscopic linear channels | Da, Re Marco; Grubišić, Sonja ; Ancilotto, Francesco | Article | |
| 2009 | Van der Waals interactions at surfaces by density functional theory using Wannier functions | Silvestrelli, Pier Luigi; Benyahia, Karima; Grubisic, Sonja ; Ancilotto, Francesco; Toigo, Flavio | Article | |
| 2009 | Molecular mechanics description of the stabilized effects in (ethylenediamine-N,N '-diacetato)chromate(III) dinuclear complex bridged by pyrazole-3,5-dicarboxylate: DFT calculations of magnetic properties | Grubišić, Sonja ; Gruden-Pavlović, Maja ; Radanović, Dušanka D. ; Perić, Marko ; Niketić, Svetozar R. | Article | |
| 2007 | Structural analysis of conformational flexibility in (aqua) (propanediamine-N,N'-diacetato-N-propionato)chromium(III) dihydrate. Crystal structure of cis-polar, trans(H2O, O-5)-[Cr(1,3-pddap)(H2O)]center dot 2H(2)O | Grubišić, Sonja ; Gruden-Pavlović, Maja ; Niketić, Svetozar R.; Sakagami-Yoshida, Narumi; Kaizaki, Sumio | Article | |
| 2007 | Conformational study of Co(II), Ni(II), and Cr(III) complexes of the edta-type: Crystal structure of 1D polymeric trans(O6)-Ba[Co(1,3-pddadp)] · 8H2O complex stabilized by infinite water tapes | Grubišić, Sonja ; Radanović, Dušanka ; Rychlewska, Urszula; Warzajtis, Beata; Drašković, Nenad S. ; Đuran, Miloš ; Niketić, Svetozar R. | Article | |
| 2007 | Molecular mechanics study of nickel(II) octaethylporphyrin adsorbed on graphite(0001) | Gruden-Pavlović, Maja ; Grubišić, Sonja ; Zlatar, Matija ; Niketić, Svetozar R. | Article | |
| 2006 | Conformational analysis of edta-type rhodium(III) complexes with mixed five- and six-membered chelate rings. Structural analysis of conformational flexibility in rhodium(III) complexes containing 1,3-propanediamine-N,N′-diacetate-N,N′-di-3-propionate ligand | Grubišić, Sonja ; Milčić, Miloš ; Radanović, Dušanka ; Niketić, Svetozar R. | Article | |
| 2005 | Layered crystal structure of the trans(O5O6) isomer of potassium (1,3-propanediamine-N,N '-diacetato-N,N '-di-3-propionato) cobaltate(III) trihydrate, trans(O5O6)-K[Co(1,3-pddadp)] center dot 3H(2)O, stabilized by ionic, hydrogen bond and C=O dipolar inte | Grubišić, Sonja ; Niketić, Svetozar R.; Radanović, Dušanka ; Rychlewska, Urszula; Warzajtis, B. | Article | |
| 2004 | Conformational analysis of octa- and tetrabromo tetraphenylporphyrins and their Ni(II) and Tb(III) complexes | Gruden-Pavlović, Maja ; Grubišić, Sonja ; Niketić, Svetozar R. | Article | |
| 2003 | Structural characterization and conformational analysis of (aqua)(ethylenediamine-N,N,N '-triacetato)chromium(III) monohydrate complex. Crystal structure of the cis-equatorial isomer of [Cr(ed3a)(H2O)]center dot H2O | Grubišić, Sonja ; Gruden-Pavlović, Maja ; Niketic, SR; Kaizaki, S; Sakagami-Yoshida, N | Article | |
| 2003 | Structural characterization of the trans-equatorial isomer of (aqua)(ethylenediamine-N,N,N '-tripropionato)chromium(III) trihydrate, [Cr(edtrp)(H2O)]center dot 3H(2)O | Grubišić, Sonja ; Gruden-Pavlović, Maja ; Niketic, SR; Sakagami-Yoshida, N; Kaizaki, S | Article | |
| 2002 | Conformational analysis of EDTA-type chromium(III) complexes with beta-propionato metal chelate rings | Grubišić, Sonja ; Gruden-Pavlović, Maja ; Niketic, SR; Sakagami-Yoshida, N; Kaizaki, S | Article | |
| 2001 | Conformational analysis of octa- and tetrahalogenated tetraphenylporphyrins and their metal derivatives | Gruden-Pavlović, Maja ; Grubišić, Sonja ; Coutsolelos, AG; Niketic, SR | Article | |