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Naslov Investigation of the reactivity properties of a thiourea derivative with anticancer activity by DFT and MD simulations (Article)
Autori Mary Sheena Y Mary Shyma Y Bielenica Anna Armakovic Stevan  Armakovic Sanja J  Chandramohan Vivek Dammalli Manjunath 
Info JOURNAL OF MOLECULAR MODELING, (2021), vol. 27 br. 8, str. -
Projekat Ministry of Education, Science and Technological Development, Serbia [451-03-68/2020-14/200125]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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Naslov Experimental and computational analysis of 1-(4-chloro-3-nitrophenyl)-3-(3,4-dichlorophenyl)thiourea (Article)
Autori Bielenica Anna Beegum Shargina Sheena Mary Y Shyma Mary Y Thomas Renjith Armakovic Stevan  Armakovic Sanja J  Madeddu Silvia Struga Marta Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2020), vol. 1205 br. , str. -
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 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 Investigation of spectroscopic, reactive, transport and docking properties of 1-(3,4-dichloropheny1)-3[3-(trifluoromethyl)phenyl] thiourea (ANF-6): Combined experimental and computational study (Article)
Autori Aswathy VV Mary Sheena Y Jojo PJ Panicker C Yohannan Bielenica Anna Armakovic Stevan  Armakovic Sanja J  Brzozka Paulina Krukowski Sylwester Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1134 br. , str. 668-680
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 Spectroscopic, single crystal XRD structure, DFT and molecular dynamics investigation of 1-(3-chloro-4-fluorophenyl)-3-[3-(trifluoromethyl)phenyl]thiourea (Article)
Autori Mary Sheena Y Aswathy VV Panicker C Yohannan Bielenica Anna Brzozka Paulina Savczenko Oleksandra Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian 
Info RSC Advances, (2016), vol. 6 br. 113, str. 111997-112015
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   Scopus  
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