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Research outputs

Influence of hydrogen bonds on edge-to-face interactions between pyridine molecules   [2018]

Andrić, Jelena M.  ; Antonijević, Ivana S.  ; Janjić, Goran V.  ; Zarić, Snežana D.  

Computational and spectroscopic data correlation study of N,N '-bisarylmalonamides (Part II)   [2015]

Arsovski, Violeta M; Božić, Bojan  ; Lađarević, Jelena  ; Vitnik, Vesna  ; Vitnik, Željko  ; Petrović, Slobodan; Ušćumlić, Gordana ; Mijin, Dušan  

The stacking interactions of bipyridine complexes: the influence of the metal ion type on the strength of interactions   [2016]

Sredojević, Dušan N.  ; Petrović, Predrag ; Janjić, Goran V.  ; Brothers, Edward N.; Hall, Michael B.; Zarić, Snežana D.  

In silico screening for antibiotic escort molecules to overcome efflux   [2011]

Rahman, Sheikh S.; Simovic, Ivana; Gibbons, Simon; Zloh, Mire  

A reexamination of the propensities of amino acids towards a particular secondary structure: classification of amino acids based on their chemical structure   [2008]

Malkov, Sasa N.  ; Živković, Miodrag V.; Beljanski, Milos V.  ; Hall, Michael B.; Zarić, Snežana D.  

Triethanolammonium acetate as a multifunctional ionic liquid in the palladium-catalyzed green Heck reaction   [2012]

Petrović, Zorica  ; Markovic, Svetlana  ; Petrović, Vladimir  ; Simijonović, Dušica  

Active components of frequently used β-blockers from the aspect of computational study   [2012]

Armaković, Stevan  ; Armaković, Sanja  ; Šetrajčić, Jovan ; Šetrajčić, Igor 

Docking studies suggest ligand-specific delta-opioid receptor conformations   [2009]

Micovic, Vuk; Ivanović, Milovan ; Došen-Mićović, Ljiljana

Investigation of the reactivity properties of a thiourea derivative with anticancer activity by DFT and MD simulations   [2021]

Mary Y. Sheena; Mary Y. Shyma; Bielenica Anna; Armaković Stevan  ; Armaković Sanja  ; Chandramohan Vivek; Dammalli Manjunath

Theoretical investigation of loratadine reactivity in order to understand its degradation properties: DFT and MD study   [2016]

Armaković, Stevan  ; Armaković, Sanja  ; Abramović, Biljana 

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