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Research outputs

The anesthetic action of some polyhalogenated ethers-Monte Carlo method based QSAR study   [2018]

Golubović, Mlađan  ; Lazarević, Milan  ; Zlatanović, Dragan  ; Krtinić, Dane  ; Stoičkov, Viktor  ; Mladenović, Bojan  ; Milić, Dragan J. ; Sokolović, Dušan  ; Veselinović, Aleksandar  

Comparative antiradical activity and molecular Docking/Dynamics analysis of octopamine and norepinephrine: the role of OH groups   [2020]

Dimić, Dušan  ; Milanović, Žiko  ; Jovanović, Goran; Sretenović, Dragana  ; Milenković, Dejan  ; Marković, Zoran  ; Dimitrić-Marković, Jasmina  

QSAR modeling of the antimicrobial activity of peptides as a mathematical function of a sequence of amino acids   [2015]

Toropova, Mariya A.; Veselinović, Aleksandar  ; Veselinović, Jovana ; Stojanović, Dušica ; Toropov, Andrey A.

Integration of 3D-QSAR, molecular docking, and machine learning techniques for rational design of nicotinamide-based SIRT2 inhibitors   [2024]

Ilić, Aleksandra  ; Đoković, Nemanja  ; Đikić, Teodora ; Nikolić, Katarina  

In silico development of anesthetics based on barbiturate and thiobarbiturate inhibition of GABAA   [2020]

Stošić, Biljana  ; Janković, Radmilo  ; Stošić, Marija  ; Marković, Danica; Stanković, Danijela; Sokolović, Dušan  ; Veselinović, Aleksandar M.  

Graphs with maximum connectivity index   [2003]

Caporossi, G; Gutman, Ivan  ; Hansen, P; Pavlovic, L

A computational framework for the design and development of ERK2 and multi-target ERK2/HDAC inhibitors   [2025]

Cebzan, Alen; Ružić, Dušan  ; Đoković, Nemanja  ; Stanković, Branislav  ; Nikolić, Katarina  

Development and design of novel cardiovascular therapeutics based on Rho kinase inhibition—In silico approach   [2019]

Ćirić, Zdravković Snezana  ; Pavlović, Milan  ; Apostlović, Svetlana  ; Koraćević, Goran  ; Šalinger, Martinović Sonja  ; Stanojević, Dragana; Sokolović, Dušan  ; Veselinović, Aleksandar  

In vitro antitumor activity, ADME-Tox and 3D-QSAR of synthesized and selected natural styryl lactones   [2019]

Vukić, Vladimir  ; Lončar, Davor; Vukić, Dajana  ; Jevrić, Lidija  ; Benedeković, Goran  ; Francuz, Jovana  ; Kojić, Vesna  ; Karadžić Banjac, Milica  ; Popsavin, Velimir 

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