Researchers



Results 141-160 of 260
Issue DateTitleAuthor(s)TypeМp-cat.
2018Spectroscopic characterization of hydroxyquinoline derivatives with bromine and iodine atoms and theoretical investigation by DFT calculations, MD simulations and molecular docking studiesSureshkumar, B.; Mary, Y.Sheena; Resmi, K.S.; Suma, S.; Armaković, Stevan  ; Armaković, Sanja  ; Van, Alsenoy C.; Narayana, B.; Sobhana, D.Article
22M22
2018Spectroscopic analysis of 8-hydroxyquinoline derivatives and investigation of its reactive properties by DFT and molecular dynamics simulationsSureshkumar B.; Sheena Mary; Resmi K.S.; Cyohannan Yohannan Panicker; Armaković Stevan  ; Armaković Sanja  ; Van Alsenoy C.; Narayana B.; Suma S.Article
22M22
2018X-ray crystallographic and computational study of biologicaly active androst-5-ene derivativesOlivera Klisurić  ; S Armaković  ; S Armaković  ; S. Lj. Vrbaški; Kuzminac, Ivana Z.  ; Dimitar Jakimov; Suzana Jovanović-Šanta  Conference Paper
Mp. category will be shown later
2018Synthesis, spectroscopic analyses, chemical reactivity and molecular docking study and anti-tubercular activity of pyrazine and condensed oxadiazole derivativesAl-Tamimi, Abdul-Malek S.; Mary, Y. Sheena; Miniyar, Pankaj B.; Al-Wahaibi, Lamya H.; El-Emam, Ali A.; Armaković, Stevan  ; Armaković, Sanja  Article
22M22
2018Interactions of Schiff base compounds and their coordination complexes with the drug cisplatinMađari, Jožef; Barta Holo, Berta  ; Vojinović Ješić, Ljiljana  ; Radanović, Mirjana  ; Armaković, Stevan  ; Armaković, Sanja  ; Molnár, Joseph; Kincses, Annamária; Gajdács, Márió; Spengler, Gabriella;
Mesaroš Sečenji, Katalin ;
Article
21M21
2018Spectroscopic characterization of 8-hydroxy-5-nitroquinoline and 5-chloro-8-hydroxy quinoline and investigation of its reactive properties by DFT calculations and molecular dynamics simulationsSureshkumar, B.; Sheena, Mary Y.; Suma, S.; Armaković, Stevan  ; Armaković, Sanja  ; Alsenoy, C. Van; Narayana, B.; Sasidharan, Binil P.Article
22M22
2018Molecular dynamic simulations, ALIE surface, Fukui functions geometrical, molecular docking and vibrational spectra studies of tetra chloro p and m-xyleneVenkatesh, G.; Kamal, C.; Vennila, P.; Govindaraju, M.; Mary, Y. Sheena; Armaković, Stevan  ; Armaković, Sanja  ; Kaya, S.; Panicker, C. YohannanArticle
22M22
2018Photocatalytic decomposition of selected biologically active compounds in environmental waters using TiO 2 /polyaniline nanocomposites: Kinetics, toxicity and intermediates assessmentŠojić Merkulov, Daniela V.  ; Despotović, Vesna N.  ; Banić, Nemanja D.  ; Armaković, Sanja J.  ; Finčur, Nina L.  ; Lazarević, Marina J. ; Četojević-Simin, Dragana D.  ; Orčić, Dejan Z.  ; Radoičić, Marija B.  ; Šaponjić, Zoran  ;
Čomor, Mirjana  ; Abramović, Biljana F. ;
Article
21aM21a
2018Synthesis, characterization and computational studies of semicarbazide derivativeMuthukkumar, M.; Bhuvaneswari, T.; Venkatesh, G.; Kamal, C.; Vennila, P.; Armaković, Stevan  ; Armaković, Sanja  ; Sheena, Mary Y.; Yohannan, Panicker C.Article
21M21
2018Photocatalytic degradation of 4-amino-6-chlorobenzene-1,3-disulfonamide stable hydrolysis product of hydrochlorothiazide: Detection of intermediates and their toxicityArmaković, Sanja  ; Armaković, Stevan  ; Četojević-Simin, Dragana  ; Šibul, Filip  ; Abramović, Biljana Article
21aM21a
2018Two novel imidazole derivatives – Combined experimental and computational studySmitha, M.; Mary, Y. Sheena; Hossain, Mossaraf; Resmi, K.S.; Armaković, Stevan  ; Armaković, Sanja  ; Pavithran, Rani; Nanda, Ashis Kumar; Van, Alsenoy C.Article
22M22
20184-[(4-Acetylphenyl)amino]-2-methylidene-4-oxobutanoic acid, a newly synthesized amide with hydrophilic and hydrophobic segments: Spectroscopic characterization and investigation of reactive propertiesSheena Mary; Al Abdullah E.; Aljohar H.; Narayana B.; Nayak P.; Sarojini B.K.; Armaković Stevan  ; Armaković Sanja  ; Van Alsenoy C.; El Emam AliArticle
22M22
2018Synthesis, spectroscopic analyses (FT-IR and NMR), vibrational study, chemical reactivity and molecular docking study and anti-tubercular activity of condensed oxadiazole and pyrazine derivativesEl-Azab, Adel S.; Mary, Y. Sheena; Abdel-Aziz, Alaa A.M.; Miniyar, Pankaj B.; Armaković, Stevan  ; Armaković, Sanja  Article
22M22
2018Combined spectroscopic, DFT, TD-DFT and MD study of newly synthesized thiourea derivativeMenon, Vidya V.; Sheena, Mary Y.; Shyma, Mary Y.; Panicker, C. Yohannan; Bielenica, Anna; Armaković, Stevan  ; Armaković, Sanja  ; Van, Alsenoy ChristianArticle
22M22
2017Theoretical investigation on the reactivity and photophysical properties of cobalt(II) and manganese(II) complexes constructed using Schiff base ligands based on ALIE and TDDFT calculationsShiva, Prasad Kollur; Pillai, Renjith Raveendran; Armaković, Stevan  ; Armaković, Sanja  Article
22M22
2017FT-IR, FT-Raman and NMR characterization of 2-isopropyl-5-methylcyclohexyl quinoline-2-carboxylate and investigation of its reactive and optoelectronic properties by molecular dynamics simulations and DFT calculationsMenon, Vidya V.; Fazal, Edakot; Mary, Y.Sheena; Panicker, C.Yohannan; Armaković, Stevan  ; Armaković, Sanja  ; Nagarajan, Subban; Van, Alsenoy C.Article
22M22
2017Spectroscopic, DFT, molecular dynamics and molecular docking study of 1-butyl-2-(4-hydroxyphenyl)-4,5-dimethyl-imidazole 3-oxideBenzon, K.B.; Mary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Armaković, Stevan  ; Armaković, Sanja  ; Pradhan, Kiran; Nanda, Ashis Kumar; Van, Alsenoy C.Article
22M22
2017Self-assembling, Reactivity and Molecular Dynamics of Fullerenol NanoparticlesVraneš, Milan  ; Borišev, Ivana  ; Tot, Aleksandar ; Armaković, Stevan  ; Armaković, Sanja  ; Jović, Danica  ; Gadžurić, Slobodan  ; Đorđević, Aleksandar  Article
21aM21a
2017FT-IR and FT-Raman characterization and investigation of reactive properties of N-(3-iodo-4-methylphenyl)pyrazine-2-carboxamide by molecular dynamics simulations and DFT calculationsRanjith, P.K.; Al-Abdullah, Ebtehal S.; Al-Omary, Fatmah A.M.; El-Emam, Ali A.; Anto, P.L.; Sheena, Mary Y.; Armaković, Stevan  ; Armaković, Sanja  ; Zitko, Jan; Dolezal, Martin;
Van, Alsenoy C.;
Article
22M22
2017Vibrational spectroscopic analysis of cyanopyrazine-2-carboxamide derivatives and investigation of their reactive properties by DFT calculations and molecular dynamics simulationsBeegum, Shargina; Mary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Armaković, Stevan  ; Armaković, Sanja  ; Zitko, Jan; Dolezal, Martin; Van, Alsenoy C.Article
22M22