Researchers



Results 121-140 of 260
Issue DateTitleAuthor(s)TypeМp-cat.
2019Computational evaluation of the reactivity and pharmaceutical potential of an organic amine: A DFT, molecular dynamics simulations and molecular docking approachAbraham, Christina Susan; Muthu, S.; Prasana, Johanan Christian; Armaković, Stevan  ; Armaković, Sanja  ; Rizwana, B. Fathima; Geoffrey, Ben; David, R. Host AntonyArticle
21M21
2019Efficiency of La-doped TiO2 calcined at different temperatures in photocatalytic degradation of β-blockersArmaković, Sanja  ; Grujić-Brojčin, Mirjana  ; Šćepanović, Maja ; Armaković, Stevan  ; Golubović, Aleksandar ; Babić, Biljana  ; Abramović, Biljana Article
21M21
2019Spectroscopic, antimicrobial and computational study of novel benzoxazole derivativeBeegum, Shargina; Mary, Y Sheena; Panicker, C. Yohannan; Armaković, Stevan  ; Armaković, Sanja  ; Arisoy, Mustafa; Temiz-Arpaci, Ozlem; Van, Alsenoy ChristianArticle
22M22
2019Synthesis, conformational, characterization and reactivity study of 1,7-bis(4-bromophenyl)heptane-1,7-dioneMurthy, P. Krishna; Suneetha, V.; Smitha, M.; Mary, Y. Sheena; Armaković, Stevan  ; Armaković, Sanja  ; Rao, R. Sreenivasa; Suchetan, P.A.; Al-Saadi, Abdulaziz A.; Pavithran, RaniArticle
22M22
2019Synthesis, spectroscopic characterization, reactive properties by DFT calculations, molecular dynamics simulations and biological evaluation of Schiff bases tethered 1,2,4-triazole and pyrazole ringsPillai, Renjith Raveendran; Karrouchi, Khalid; Fettach, Saad; Armaković, Stevan  ; Armaković, Sanja  ; Brik, Younes; Taoufik, Jamal; Radi, Smaail; El, Abbes Faouzi My; Ansar, M'hammedArticle
22M22
2019Photophysical properties and theoretical investigations of newly synthesized pyrene-naphthalene based Schiff base ligand and its copper(II) complexesPrasad, Kollur Shiva; Pillai, Renjith Raveendran; Armaković, Stevan  ; Armaković, Sanja  Article
22M22
2019Design, synthesis and computational analysis of novel acridine-(sulfadiazine/sulfathiazole) hybrids as antibacterial agentsGündüz, Miyase Gözde; Tahir, Muhammad Nawaz; Armaković, Stevan  ; Özkul, Koçak Ceren; Armaković, Sanja  Article
22M22
2019Molecular structure, optoelectronic properties, spectroscopic (FT-IR, FT-Raman and UV–Vis), H-BDE, NBO and drug likeness investigations on 7, 8-benzocoumarin-4-acetic acid (7BAA)Khemalapure, Seema S.; Katti, Vinay S.; Hiremath, Chidanandayya S.; Basanagouda, Mahantesha; Hiremath, Sudhir M.; Armaković, Sanja  ; Armaković, Stevan  Article
22M22
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 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
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
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
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
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
2018Structural and spectroscopic characterization, reactivity study and charge transfer analysis of the newly synthetized 2-(6-hydroxy-1-benzofuran-3-yl) acetic acidMurthy, P. Krishna; Krishnaswamy, G.; Armaković, Stevan  ; Armaković, Sanja  ; Suchetan, P.A.; Desai, Nivedita R.; Suneetha, V.; SreenivasaRao, R.; Bhargavi, G.; Aruna, Kumar D.B.Article
22M22
2018Understanding reactivity of two newly synthetized imidazol derivatives by spectroscopic characterization and computational studyHossain Mossaraf; Thomas Renjith; Sheena Mary; Resmi K.S.; Armaković Stevan  ; Armaković Sanja  ; Kumar Ashis Nanda; Vijayakumar G.; Van Alsenoy C.Article
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
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
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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