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Autori: Mary Sheena Y

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Naslov 4-[(4-Acetylphenyl)amino]-2-methylidene-4-oxobutanoic acid, a newly synthesized amide with hydrophilic and hydrophobic segments: Spectroscopic characterization and investigation of its reactive properties (Article)
Autori Mary Sheena Y Al-Abdullah Ebtehal S Aljohar Haya I Narayana Badiadka Nayak Prakash S Sarojini Baladka K Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian El-Emam Ali A 
Info JOURNAL OF THE SERBIAN CHEMICAL SOCIETY, (2018), vol. 83 br. 1, str. 1-18
Projekat Deanship of Scientific Research at King Saud University [RG-1435-062]; Schrodinger Inc.
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Understanding reactivity of two newly synthetized imidazole derivatives by spectroscopic characterization and computational study (Article)
Autori Hossain Mossaraf Thomas Renjith Mary Sheena Y Resmi KS Armakovic Stevan  Armakovic Sanja J  Nanda Ashis Kumar Vijayakumar G Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1158 br. , str. 176-196
Projekat Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [OI 171039, TR 34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Spectroscopic analysis and molecular docking of imidazole derivatives and investigation of its reactive properties by DFT and molecular dynamics simulations (Article)
Autori Thomas Renjith Hossain Mossaraf Mary Sheena Y Resmi KS Armakovic Stevan  Armakovic Sanja J  Nanda Ashis Kumar Ranjan Vivek Kumar Vijayakumar G Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1158 br. , str. 156-175
Projekat Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [OI 171039, TR 34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Synthesis, spectroscopic analyses (FT-IR and NMR), vibrational study, chemical reactivity and molecular docking study and anti-tubercular activity of condensed oxadiazole and pyrazine derivatives (Article)
Autori El-Azab Adel S Mary Sheena Y Abdel-Aziz Alaa A-M Miniyar Pankaj B Armakovic Stevan  Armakovic Sanja J  
Info JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1156 br. , str. 657-674
Projekat King Saud University [RG-1435-046]; Schrodinger Inc.
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Spectroscopic analysis of 8-hydroxyquinoline derivatives and investigation of its reactive properties by DFT and molecular dynamics simulations (Article)
Autori Sureshkumar Bhaskaran Mary Sheena Y Resmi KS Panicker C Yohannan Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian Narayana Badiadka Suma Somasekharan 
Info JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1156 br. , str. 336-347
Projekat Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [OI 171039, TR 34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Combined spectroscopic, DFr, TD-DFT and MD study of newly synthesized thiourea derivative (Article)
Autori Menon Vidya V Mary Sheena Y Mary Sheena Y Panicker C Yohannan Bielenica Anna Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1155 br. , str. 184-195
Projekat Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [ON171039, TR34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science  
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Naslov A complete computational and spectroscopic study of 2-bromo-1, 4-dichlorobenzene - A frequently used benzene derivative (Article)
Autori Vennila P Govindaraju M Venkatesh G Kamal C Mary Sheena Y Panicker C Yohannan Kaya S Armakovic Stevan  Armakovic Sanja J  
Info JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1151 br. , str. 245-255
Projekat Schriodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [01171039, TR 34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Spectroscopic analysis of 8-hydroxyquinoline-5-sulphonic acid and investigation of its reactive properties by DFT and molecular dynamics simulations (Article)
Autori Sureshkumar Bhaskaran Mary Sheena Y Panicker C Yohannan Resmi KS Suma Somasekharan Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1150 br. , str. 540-552
Projekat Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [OI 171039, TR 34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Supramolecular architecture of 5-bromo-7-methoxy-1-methyl-1H-benzoimidazole center dot 3H(2)O: Synthesis, spectroscopic investigations, DFT computation, MD simulations and docking studies (Article)
Autori Murthy Krishna P Smitha M Mary Sheena Y Armakovic Stevan  Armakovic Sanja J  Rao R Sreenivasa Suchetan PA Giri L Pavithran Rani Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1149 br. , str. 602-612
Projekat UGC [3797]; Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [01171039, TR 34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science  
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Naslov Synthesis, XRD single crystal structure analysis, vibrational spectral analysis, molecular dynamics and molecular docking studies of 2-(3-methoxy-4-hydroxyphenyl) benzothiazole (Article)
Autori Devi A Sarau Aswathy VV Mary Sheena Y Panicker C Yohannan Armakovic Stevan  Armakovic Sanja J  Ravindran Reena Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1148 br. , str. 282-292
Projekat Schrodinger Inc.; Ministry of Education, Science and Technological Development of Serbia [OI 171039, TR 34019]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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