Autori: Armakovic Sanja J
Naslov | Synthesis, spectroscopic characterization, reactive properties by DFT calculations, molecular dynamics simulations and biological evaluation of Schiff bases tethered 1,2,4-triazole and pyrazole rings (Article) |
Autori | Pillai Renjith Raveendran Karrouchi Khalid Fettach Saad Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR STRUCTURE, (2019), vol. 1177 br. , str. 47-54 |
Projekat | Ministry of Education, Science and Technological Development of Serbia [11141017]; Schrodinger Inc. |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Spectroscopic, antimicrobial and computational study of novel benzoxazole derivative (Article) |
Autori | Beegum Shargina Mary Sheena Y Panicker C Yohannan Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR STRUCTURE, (2019), vol. 1176 br. , str. 881-894 |
Projekat | Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Synthesis, conformational, characterization and reactivity study of 1,7-bis(4-bromophenyl)heptane-1,7-dione (Article) |
Autori | Krishna-Murthy P Suneetha V Smitha M Mary Sheena Y Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR STRUCTURE, (2019), vol. 1175 br. , str. 269-279 |
Projekat | UGC; Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Spectroscopic profiling (FT-IR, FT-Raman, NMR and UV-Vis), autoxidation mechanism (H-BDE) and molecular docking investigation of 3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine by DFT/TD-DFT and molecular dynamics: A potential SSRI drug (Article) |
Autori | Abraham Christina Susan Muthu S Prasana Johanan Christian Armakovic Sanja J ![]() ![]() |
Info | COMPUTATIONAL BIOLOGY AND CHEMISTRY, (2018), vol. 77 br. , str. 131-145 |
Projekat | Schrodinger Inc. - Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Synthesis, characterization and computational studies of semicarbazide derivative (Article) |
Autori | Muthukkumar M Bhuvaneswari T Venkatesh G Kamal C Vennila P Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR LIQUIDS, (2018), vol. 272 br. , str. 481-495 |
Projekat | Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Synthesis and spectroscopic study of three new oxadiazole derivatives with detailed computational evaluation of their reactivity and pharmaceutical potential (Article) |
Autori | Mary Sheena Y Miniyar Pankaj B Mary Sheena Y Resmi KS Panicker C Yohannan Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1173 br. , str. 469-480 |
Projekat | Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Two novel imidazole derivatives - Combined experimental and computational study (Article) |
Autori | Smitha M Mary Sheena Y Hossain Mossaraf Resmi KS Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1173 br. , str. 221-239 |
Projekat | Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Synthesis of 5-(5-methyl-benzofuran-3-ylmethyl)-3H-[1,3,4] oxadiazole-2-thione and investigation of its spectroscopic, reactivity, optoelectronic and drug likeness properties by combined computational and experimental approach (Article) |
Autori | Hiremath Sudhir M Suvitha A Patil Ninganagouda R Hiremath Chidanandayya S Khemalapure Seema S Pattanayak Subrat K Negalurmath Veerabhadrayya S Obelannavar Kotresh Armakovic Sanja J ![]() ![]() |
Info | SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, (2018), vol. 205 br. , str. 95-110 |
Projekat | Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Vibrational and electronic absorption spectroscopic profiling, natural hybrid orbital, charge transfer, electron localization function and molecular docking analysis on 3-amino-3-(2-nitrophenyl) propionic acid (Article) |
Autori | Abraham Christina Susan Muthu S Prasana Johanan Christian Rizwana Fathima B Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1171 br. , str. 733-746 |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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Naslov | Molecular dynamic simulations, ALIE surface, Fukui functions geometrical, molecular docking and vibrational spectra studies of tetra chloro p and m-xylene (Article) |
Autori | Venkatesh G Kamal C Vennila P Govindaraju M Mary Sheena Y Armakovic Stevan ![]() ![]() |
Info | JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1171 br. , str. 253-267 |
Projekat | Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [III41017] |
Ispravka | Web of Science Članak Elečas Rang časopisa Citati: Web of Science Scopus |
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