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Rezultati 81-100 od 305
GodinaNaslovAutor(i)Tip rezultataMp-kat.
2022Insights into the reactivity properties, docking, DFT and MD simulations of orphenadrinium dihydrogen citrate in different solventsS.Al-Otaibi Jamelah; Mary Y. Sheena; Mary Y. Shyma; Armaković Sanja  ; Armaković Stevan  ; Van Alsenoy C.; Yathirajan H. S.Naučni članak
21aM21a - Vodeći međunarodni časopis kategorije M21a
2021Influence of water quality on stability of hydrochlorothiazide detected in drinking and environmental water: Experimental and computational analysisUzelac Maria  ; Srđenović Čonić Branislava  ; Kladar Nebojša  ; Armaković Stevan  ; Armaković Sanja  Konferencijski rad
Mp kategorija će biti prikazana naknadno.
2021Investigation of the reactivity properties of a thiourea derivative with anticancer activity by DFT and MD simulationsMary Y. Sheena; Mary Y. Shyma; Bielenica Anna; Armaković Stevan  ; Armaković Sanja  ; Chandramohan Vivek; Dammalli ManjunathNaučni članak
22M22 - Međunarodni časopis kategorije M22
2021Biomass waste utilization for adsorbent preparation in CO2 capture and sustainable environment applicationsMumtaz H.; Farhan M.; Amjad M.; Riaz F.; Kazim A.H.; Sultan M.; Farooq M.; Mujtaba M.A.; Hussain I.; Imran M.;
Anwar S.; El-Sherbeeny A.M.; Siddique F.A.; Armaković Stevan  ; Ali Q.; Chaudhry I.A.; Pettinau A.;
Naučni članak
21M21 - Vodeći međunarodni časopis kategorije M21
2021Concentration and solvent dependent SERS, DFT, MD simulations and molecular docking studies of a thioxothiazolidine derivative with antimicrobial propertiesMary Y. Sheena; Mary Y. Shyma; Armaković Stevan  ; Armaković Sanja  ; Krátký Martin; Vinsova Jarmila; Baraldi Cecilia; Gamberini Maria CristinaNaučni članak
21aM21a - Vodeći međunarodni časopis kategorije M21a
2021Using experimental and computational tools to map degradation mechanisms associated with toxicity of selected β-blockersUzelac Maria  ; Armaković Sanja  ; Armaković Stevan  ; Gašić Uroš  ; Četojević Dragana; Banić Nemanja  Konferencijski rad
Mp kategorija će biti prikazana naknadno.
2021Stability and reactivity study of bio-molecules brucine and colchicine towards electrophile and nucleophile attacks: Insight from DFT and MD simulationsMary Y. Sheena; Mary Y. Shyma; Armaković Stevan  ; Armaković Sanja  ; Yadav Rohitash; Celik Ismail; Mane Pratap; Chakraborty BrahmanandaNaučni članak
21aM21a - Vodeći međunarodni časopis kategorije M21a
2021Investigation of pharmaceutical importance of 2h-pyran-2-one analogues via computational approachesShetgaonkar Samata E.; Kollur Shiva Prasad; Pillai Renjith Raveendran; Thangavel Karthick; Armaković Sanja  ; Armaković Stevan  ; Shivamallu Chandan; Amachawadi Raghavendra G.; Syed Asad; Elgorban Abdallah M.;
Bahkali Ali H.; Singh Fateh V.;
Naučni članak
21M21 - Vodeći međunarodni časopis kategorije M21
2021Optoelectronic properties of the newly designed 1,3,5-triazine derivatives with isatin, chalcone and acridone moietiesArmaković Sanja  ; Mary Y. Sheena; Mary Y. Shyma; Пелемиш Светлана ; Armaković Stevan  Naučni članak
23M23 - Međunarodni časopis kategorije M23
2021Crystal structure determination and computational studies of 1,4-dihydropyridine derivatives as selective T-type calcium channel blockersGündüz Miyase Gözde; Armaković Sanja  ; Dengiz Cagatay; Tahir Muhammad Nawaz; Armaković Stevan  Naučni članak
22M22 - Međunarodni časopis kategorije M22
2021Reactivity properties and adsorption behavior of a triazole derivative – DFT and MD simulation studiesAl-Ghulikah Hanan A.; Al-Mutairi Aamal A.; Hassan Hanan M.; Emam Ali A.; Mary Y. Sheena; Mary Y. Shyma; Armaković Stevan  ; Armaković Sanja  Naučni članak
21aM21a - Vodeći međunarodni časopis kategorije M21a
2021Sumanene as a delivery system for 5-fluorouracil drug – DFT, SAPT and MD studyReichert Tom; Vučićević Marija; Hillman Paula; Bleicher Marcus; Armaković Sanja  ; Armaković Stevan  Naučni članak
21aM21a - Vodeći međunarodni časopis kategorije M21a
2021Investigation of reactive properties of an antiviral azatricyclo derivative–KDFT, MD and docking simulationsMary Y. Sheena; Mary Y. Shyma; Armaković Stevan  ; Armaković Sanja  ; Pakosinska-Parys Magdalena; Yadav Rohitash; Celik IsmailNaučni članak
22M22 - Međunarodni časopis kategorije M22
2021Investigation of reactive properties, adsorption on fullerene, DFT, molecular dynamics simulation of an anthracene derivative targeting dihydrofolate reductase and human dUTPaseSheena Mary Y.; Mary Y. Shyma; Armaković Stevan  ; Armaković Sanja  ; Yadav Rohitash; Celik Ismail; Razavi RaziehNaučni članak
21aM21a - Vodeći međunarodni časopis kategorije M21a
2021Unprecedented copper(ii) coordination induced nucleophilic cleavage of a quinoxaline heterocycle: structural and computational studiesBandopadhyay Nilaj; Joshi Mayank; Armaković Stevan  ; Armaković Sanja  ; Das Hari Sankar; Roy Choudhury Angshuman; Biswas BhaskarNaučni članak
21M21 - Vodeći međunarodni časopis kategorije M21
2021Application of TiO2 nanomaterials for water purification based on photocatalysisArmaković Sanja  ; Uzelac Maria  ; Armaković Stevan  Konferencijski rad
Mp kategorija će biti prikazana naknadno.
2020Indole moiety induced biological potency in pseudo-peptides derived from 2-amino-2-(1H-indole-2-yl) based acetamides: Chemical synthesis, in vitro anticancer activity and theoretical studiesPrasad, Kollur Shiva; Pillai, Renjith Raveendran; Ghimire, Madhav Prasad; Ray, Rajyavardhan; Richter, Manuel; Shivamallu, Chandan; Jain, Anisha S.; Prasad, Shashanka K.; Sushma, P.; Armaković, Stevan  ;
Armaković, Sanja  ; Amachawadi, Raghavendra G.;
Naučni članak
22M22 - Međunarodni časopis kategorije M22
2020Modeling of fundamental electronic circuits by the Euler method using the Python programming languageGojković Ljubomir; Malijević Stefan; Armaković Stevan  Naučni članak
23M23 - Međunarodni časopis kategorije M23
2020Kinetics, mechanism and toxicity of intermediates of solar light induced photocatalytic degradation of pindolol: Experimental and computational modeling approachArmaković, Sanja  ; Armaković, Stevan  ; Šibul, Filip  ; Četojević-Simin, Dragana  ; Tubić, Aleksandra  ; Abramović, Biljana Naučni članak
21a+M21a+ - Vodeći međunarodni časopis kategorije M21a+
2020Electronic structure of yttrium-doped zinc ferrite – Insights from experiment and theoryJankov, Stevan  ; Armaković, Stevan  ; Tóth, Elvira; Srdić, Vladimir  ; Cvejić, Željka  ; Skuban, Sonja  Naučni članak
21aM21a - Vodeći međunarodni časopis kategorije M21a