TY  - DATA
AU  - Jovanović, Milena
AU  - Gruden-Pavlović, Maja
AU  - Zlatović, Mario
PY  - 2015
UR  - https://cherry.chem.bg.ac.rs/handle/123456789/3423
PB  - Springer Wien, Wien
T2  - Monatshefte Fur Chemie
T1  - Supplementary data for article: Jovanović, M.; Gruden-Pavlović, M.; Zlatović, M. Stabilizing Non-Covalent Interactions of Ligand Aromatic Moieties and Proline in Ligand-Protein Systems. Monatshefte fur Chemie 2015, 146 (2), 389–397. https://doi.org/10.1007/s00706-014-1357-8
UR  - https://hdl.handle.net/21.15107/rcub_cherry_3423
ER  - 

@misc{
author = "Jovanović, Milena and Gruden-Pavlović, Maja and Zlatović, Mario",
year = "2015",
publisher = "Springer Wien, Wien",
journal = "Monatshefte Fur Chemie",
title = "Supplementary data for article: Jovanović, M.; Gruden-Pavlović, M.; Zlatović, M. Stabilizing Non-Covalent Interactions of Ligand Aromatic Moieties and Proline in Ligand-Protein Systems. Monatshefte fur Chemie 2015, 146 (2), 389–397. https://doi.org/10.1007/s00706-014-1357-8",
url = "https://hdl.handle.net/21.15107/rcub_cherry_3423"
}

Jovanović, M., Gruden-Pavlović, M.,& Zlatović, M.. (2015). Supplementary data for article: Jovanović, M.; Gruden-Pavlović, M.; Zlatović, M. Stabilizing Non-Covalent Interactions of Ligand Aromatic Moieties and Proline in Ligand-Protein Systems. Monatshefte fur Chemie 2015, 146 (2), 389–397. https://doi.org/10.1007/s00706-014-1357-8. in Monatshefte Fur Chemie
Springer Wien, Wien..
https://hdl.handle.net/21.15107/rcub_cherry_3423

Jovanović M, Gruden-Pavlović M, Zlatović M. Supplementary data for article: Jovanović, M.; Gruden-Pavlović, M.; Zlatović, M. Stabilizing Non-Covalent Interactions of Ligand Aromatic Moieties and Proline in Ligand-Protein Systems. Monatshefte fur Chemie 2015, 146 (2), 389–397. https://doi.org/10.1007/s00706-014-1357-8. in Monatshefte Fur Chemie. 2015;.
https://hdl.handle.net/21.15107/rcub_cherry_3423 .

Jovanović, Milena, Gruden-Pavlović, Maja, Zlatović, Mario, "Supplementary data for article: Jovanović, M.; Gruden-Pavlović, M.; Zlatović, M. Stabilizing Non-Covalent Interactions of Ligand Aromatic Moieties and Proline in Ligand-Protein Systems. Monatshefte fur Chemie 2015, 146 (2), 389–397. https://doi.org/10.1007/s00706-014-1357-8" in Monatshefte Fur Chemie (2015),
https://hdl.handle.net/21.15107/rcub_cherry_3423 .

TY  - JOUR
AU  - Jovanović, Milena
AU  - Gruden-Pavlović, Maja
AU  - Zlatović, Mario
PY  - 2015
UR  - https://cherry.chem.bg.ac.rs/handle/123456789/1652
AB  - Proline, due to its conformational specificity, is known to show some unique properties and has significant functions in the tertiary structure of proteins. It was suggested that proline could have an important influence on some vital interactions in protein as well, by engaging in non-covalent stabilization interactions with some aromatic moieties. In this work, the interactions that occur between proline and some aromatic moieties in ligands were investigated by means of the density functional theory using an exchange-correlation functional capable of taking into account dispersion interactions. The obtained results showed that the stabilization energy between a properly placed proline and an aromatic moiety could be as large as 25 kJ/mol and hence be a significant factor in placing a ligand in binding site of a protein. This indicates that the error in determining the most favorable structure of ligand-protein complexes obtained by usual molecular docking experiments sometimes could be the result of neglecting this type of interactions.
PB  - Springer Wien, Wien
T2  - Monatshefte Fur Chemie
T1  - Stabilizing non-covalent interactions of ligand aromatic moieties and proline in ligand-protein systems
VL  - 146
IS  - 2
SP  - 389
EP  - 397
DO  - 10.1007/s00706-014-1357-8
ER  - 

@article{
author = "Jovanović, Milena and Gruden-Pavlović, Maja and Zlatović, Mario",
year = "2015",
abstract = "Proline, due to its conformational specificity, is known to show some unique properties and has significant functions in the tertiary structure of proteins. It was suggested that proline could have an important influence on some vital interactions in protein as well, by engaging in non-covalent stabilization interactions with some aromatic moieties. In this work, the interactions that occur between proline and some aromatic moieties in ligands were investigated by means of the density functional theory using an exchange-correlation functional capable of taking into account dispersion interactions. The obtained results showed that the stabilization energy between a properly placed proline and an aromatic moiety could be as large as 25 kJ/mol and hence be a significant factor in placing a ligand in binding site of a protein. This indicates that the error in determining the most favorable structure of ligand-protein complexes obtained by usual molecular docking experiments sometimes could be the result of neglecting this type of interactions.",
publisher = "Springer Wien, Wien",
journal = "Monatshefte Fur Chemie",
title = "Stabilizing non-covalent interactions of ligand aromatic moieties and proline in ligand-protein systems",
volume = "146",
number = "2",
pages = "389-397",
doi = "10.1007/s00706-014-1357-8"
}

Jovanović, M., Gruden-Pavlović, M.,& Zlatović, M.. (2015). Stabilizing non-covalent interactions of ligand aromatic moieties and proline in ligand-protein systems. in Monatshefte Fur Chemie
Springer Wien, Wien., 146(2), 389-397.
https://doi.org/10.1007/s00706-014-1357-8

Jovanović M, Gruden-Pavlović M, Zlatović M. Stabilizing non-covalent interactions of ligand aromatic moieties and proline in ligand-protein systems. in Monatshefte Fur Chemie. 2015;146(2):389-397.
doi:10.1007/s00706-014-1357-8 .

Jovanović, Milena, Gruden-Pavlović, Maja, Zlatović, Mario, "Stabilizing non-covalent interactions of ligand aromatic moieties and proline in ligand-protein systems" in Monatshefte Fur Chemie, 146, no. 2 (2015):389-397,
https://doi.org/10.1007/s00706-014-1357-8 . .

TY  - JOUR
AU  - Bjelaković, Mira S.
AU  - Kop, Tatjana
AU  - Baošić, Rada
AU  - Zlatović, Mario
AU  - Zekić, Andrijana
AU  - Maslak, Veselin
AU  - Milić, Dragana
PY  - 2014
UR  - https://cherry.chem.bg.ac.rs/handle/123456789/1869
AB  - Four fullerosteroidal conjugates, previously confirmed to express two- to threefold better antioxidant activity in vitro than C-60, were subjected to additional studies, including electrochemical, theoretical, and morphological examination. All tested compounds underwent reversible, diffusion-controlled reductions. A notable influence of the solvent properties on the reduction potential, the level of aggregation, and the lowest unoccupied molecular orbital (LUMO) energy was observed. Theoretical calculations indicated that the energy gain obtained by an intermediate formation, together with compounds' polarizability, polarity, and lipophilicity contributed to the radical quenching capacity. Very large supramolecular aggregates of all fullerosteroidal esters with no hierarchical arrangement were observed in precipitated samples, while solvent induced self-assembling led to round nanoplates, which further arranged to flower-shaped hierarchically ordered architectures or uniformly distributed discoid particles. As in electrochemical studies, fine tuning of the aggregation level was achieved by the solvent.
PB  - Springer Wien, Wien
T2  - Monatshefte Fur Chemie
T1  - Electrochemical, theoretical, and morphological studies of antioxidant fullerosteroids
VL  - 145
IS  - 11
SP  - 1715
EP  - 1725
DO  - 10.1007/s00706-014-1287-5
ER  - 

@article{
author = "Bjelaković, Mira S. and Kop, Tatjana and Baošić, Rada and Zlatović, Mario and Zekić, Andrijana and Maslak, Veselin and Milić, Dragana",
year = "2014",
abstract = "Four fullerosteroidal conjugates, previously confirmed to express two- to threefold better antioxidant activity in vitro than C-60, were subjected to additional studies, including electrochemical, theoretical, and morphological examination. All tested compounds underwent reversible, diffusion-controlled reductions. A notable influence of the solvent properties on the reduction potential, the level of aggregation, and the lowest unoccupied molecular orbital (LUMO) energy was observed. Theoretical calculations indicated that the energy gain obtained by an intermediate formation, together with compounds' polarizability, polarity, and lipophilicity contributed to the radical quenching capacity. Very large supramolecular aggregates of all fullerosteroidal esters with no hierarchical arrangement were observed in precipitated samples, while solvent induced self-assembling led to round nanoplates, which further arranged to flower-shaped hierarchically ordered architectures or uniformly distributed discoid particles. As in electrochemical studies, fine tuning of the aggregation level was achieved by the solvent.",
publisher = "Springer Wien, Wien",
journal = "Monatshefte Fur Chemie",
title = "Electrochemical, theoretical, and morphological studies of antioxidant fullerosteroids",
volume = "145",
number = "11",
pages = "1715-1725",
doi = "10.1007/s00706-014-1287-5"
}

Bjelaković, M. S., Kop, T., Baošić, R., Zlatović, M., Zekić, A., Maslak, V.,& Milić, D.. (2014). Electrochemical, theoretical, and morphological studies of antioxidant fullerosteroids. in Monatshefte Fur Chemie
Springer Wien, Wien., 145(11), 1715-1725.
https://doi.org/10.1007/s00706-014-1287-5

Bjelaković MS, Kop T, Baošić R, Zlatović M, Zekić A, Maslak V, Milić D. Electrochemical, theoretical, and morphological studies of antioxidant fullerosteroids. in Monatshefte Fur Chemie. 2014;145(11):1715-1725.
doi:10.1007/s00706-014-1287-5 .

Bjelaković, Mira S., Kop, Tatjana, Baošić, Rada, Zlatović, Mario, Zekić, Andrijana, Maslak, Veselin, Milić, Dragana, "Electrochemical, theoretical, and morphological studies of antioxidant fullerosteroids" in Monatshefte Fur Chemie, 145, no. 11 (2014):1715-1725,
https://doi.org/10.1007/s00706-014-1287-5 . .

TY  - DATA
AU  - Božinović, Nina S.
AU  - Opsenica, Igor
AU  - Šolaja, Bogdan A.
PY  - 2013
UR  - https://cherry.chem.bg.ac.rs/handle/123456789/3490
PB  - Georg Thieme Verlag Kg, Stuttgart
T2  - Synlett
T1  - Supplementary data for article: Božinović, N. S.; Opsenica, I.; Šolaja, B. A. Double Palladium-Catalyzed Synthesis of Azepines. Synlett 2013, 24 (1), 49–52. https://doi.org/10.1055/s-0032-1317667
UR  - https://hdl.handle.net/21.15107/rcub_cherry_3490
ER  - 

@misc{
author = "Božinović, Nina S. and Opsenica, Igor and Šolaja, Bogdan A.",
year = "2013",
publisher = "Georg Thieme Verlag Kg, Stuttgart",
journal = "Synlett",
title = "Supplementary data for article: Božinović, N. S.; Opsenica, I.; Šolaja, B. A. Double Palladium-Catalyzed Synthesis of Azepines. Synlett 2013, 24 (1), 49–52. https://doi.org/10.1055/s-0032-1317667",
url = "https://hdl.handle.net/21.15107/rcub_cherry_3490"
}

Božinović, N. S., Opsenica, I.,& Šolaja, B. A.. (2013). Supplementary data for article: Božinović, N. S.; Opsenica, I.; Šolaja, B. A. Double Palladium-Catalyzed Synthesis of Azepines. Synlett 2013, 24 (1), 49–52. https://doi.org/10.1055/s-0032-1317667. in Synlett
Georg Thieme Verlag Kg, Stuttgart..
https://hdl.handle.net/21.15107/rcub_cherry_3490

Božinović NS, Opsenica I, Šolaja BA. Supplementary data for article: Božinović, N. S.; Opsenica, I.; Šolaja, B. A. Double Palladium-Catalyzed Synthesis of Azepines. Synlett 2013, 24 (1), 49–52. https://doi.org/10.1055/s-0032-1317667. in Synlett. 2013;.
https://hdl.handle.net/21.15107/rcub_cherry_3490 .

Božinović, Nina S., Opsenica, Igor, Šolaja, Bogdan A., "Supplementary data for article: Božinović, N. S.; Opsenica, I.; Šolaja, B. A. Double Palladium-Catalyzed Synthesis of Azepines. Synlett 2013, 24 (1), 49–52. https://doi.org/10.1055/s-0032-1317667" in Synlett (2013),
https://hdl.handle.net/21.15107/rcub_cherry_3490 .

TY  - JOUR
AU  - Božinović, Nina S.
AU  - Opsenica, Igor
AU  - Šolaja, Bogdan A.
PY  - 2013
UR  - https://cherry.chem.bg.ac.rs/handle/123456789/1597
AB  - The synthesis of new 5H-pyridobenzazepine and 5H-dipyridoazepine compounds using as key step a palladium-catalyzed amination-cyclization reaction is reported. By choosing an appropriate combination of ligands and reactants under standardized reaction conditions, N- and S-tricyclic products can be prepared in one step from the appropriate stilbenes.
PB  - Georg Thieme Verlag Kg, Stuttgart
T2  - Synlett
T1  - Double Palladium-Catalyzed Synthesis of Azepines
VL  - 24
IS  - 1
SP  - 49
EP  - 52
DO  - 10.1055/s-0032-1317667
ER  - 

@article{
author = "Božinović, Nina S. and Opsenica, Igor and Šolaja, Bogdan A.",
year = "2013",
abstract = "The synthesis of new 5H-pyridobenzazepine and 5H-dipyridoazepine compounds using as key step a palladium-catalyzed amination-cyclization reaction is reported. By choosing an appropriate combination of ligands and reactants under standardized reaction conditions, N- and S-tricyclic products can be prepared in one step from the appropriate stilbenes.",
publisher = "Georg Thieme Verlag Kg, Stuttgart",
journal = "Synlett",
title = "Double Palladium-Catalyzed Synthesis of Azepines",
volume = "24",
number = "1",
pages = "49-52",
doi = "10.1055/s-0032-1317667"
}

Božinović, N. S., Opsenica, I.,& Šolaja, B. A.. (2013). Double Palladium-Catalyzed Synthesis of Azepines. in Synlett
Georg Thieme Verlag Kg, Stuttgart., 24(1), 49-52.
https://doi.org/10.1055/s-0032-1317667

Božinović NS, Opsenica I, Šolaja BA. Double Palladium-Catalyzed Synthesis of Azepines. in Synlett. 2013;24(1):49-52.
doi:10.1055/s-0032-1317667 .

Božinović, Nina S., Opsenica, Igor, Šolaja, Bogdan A., "Double Palladium-Catalyzed Synthesis of Azepines" in Synlett, 24, no. 1 (2013):49-52,
https://doi.org/10.1055/s-0032-1317667 . .