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Autori: El-Emam Ali A

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Naslov Comparative MD Study of Inhibitory Activity of Opaganib and Adamantane-Isothiourea Derivatives toward COVID-19 Main Protease M-pro (Article)
Autori Djorovic-Jovanovic Jelena R  Antonijevic Marko R  El-Emam Ali A  Markovic Zoran S 
Info CHEMISTRYSELECT, (2021), vol. 6 br. 33, str. 8603-8610
Projekat Ministry of Education, Science and Technological Development, Serbia [451-03-9/2021-14/200378]
Ispravka ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science  
Naslov Synthesis, spectroscopic analyses, chemical reactivity and molecular docking study and anti-tubercular activity of pyrazine and condensed oxadiazole derivatives (Article)
Autori Al-Tamimi Abdul-Malek S  Mary Sheena Y  Miniyar Pankaj B  Al-Wahaibi Lamya H  El-Emam Ali A  Armakovic Stevan  Armakovic Sanja J 
Info JOURNAL OF MOLECULAR STRUCTURE, (2018), vol. 1164 br. , str. 459-469
Projekat Deanship of Scientific Research at Princess Nourah bint Abdulrahman University [RGP-1438-0010]
Ispravka ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science   Scopus  
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 ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science   Scopus  
Naslov Insight into the reactive properties of newly synthesized 1,2,4-triazole derivative by combined experimental (FT-IR and FR-Raman) and theoretical (DFT and MD) study (Article)
Autori Mary Sheena Y  Al-Omary Fatmah AM  Mostafa Gamal AE  El-Emam Ali A  Manjula PS  Sarojini Baladka K  Narayana Badiadka  Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1141 br. , str. 542-550
Projekat Deanship of Scientific Research at King Saud University [RG-1435-067]; Schrodinger Inc.
Ispravka ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science   Scopus  
Naslov FT-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 calculations (Article)
Autori Ranjith PK  Al-Abdullah Ebtehal S  Al-Omary Fatmah AM  El-Emam Ali A  Anto PL  Sheena Mary Y  Armakovic Stevan  Armakovic Sanja J  Zitko Jan  Dolezal Martin  Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1136 br. , str. 14-24
Projekat Deanship of Scientific Research at King Saud University [RG1435-062]; Schrodinger Inc.
Ispravka ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science   Scopus  
Naslov Synthesis, vibrational spectroscopic investigations, molecular docking, antibacterial studies and molecular dynamics study of 5-[(4-nitrophenyl)acetamido]-2-(4-tert-butylphenyl)benzoxazole (Article)
Autori Sheena-Mary Y  Al-Shehri Mona M  Jalaja K  Al-Omary Fatmah AM  El-Emam Ali A  Panicker C Yohannan  Armakovic Stevan  Armakovic Sanja J  Temiz-Arpaci Ozlem  Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1133 br. , str. 557-573
Projekat Deanship of Scientific Research at King Saud University [RGP-1435-067]; Schrodinger Inc.
Ispravka ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science   Scopus  
Naslov Reactive, spectroscopic and antimicrobial assessments of 5-[(4-methylphenyl) acetamido]-2-(4-tert-butylphenyl)benzoxazole: Combined experimental and computational study (Article)
Autori Mary Sheena Y  Alzoman Nourah Z  Menon Vidya V  Al-Abdullah Ebtehal S  El-Emam Ali A  Panicker C Yohannan  Temiz-Arpaci Ozlem  Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1128 br. , str. 694-706
Projekat Deanship of Scientific Research at King Saud University [RG-1435-062]; Schrodinger Inc.
Ispravka ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science   Scopus  
Naslov Molecular conformational analysis, reactivity, vibrational spectral analysis and molecular dynamics and docking studies of 6-chloro-5-isopropylpyrimidine-2,4(1H,3H)-dione, a potential precursor to bioactive agent (Article)
Autori Al-Omary Fatmah AM  Mary Sheena Y  Beegum Shargina  Panicker C Yohannan  Al-Shehri Mona M  El-Emam Ali A  Armakovic Stevan  Armakovic Sanja J  Van Alsenoy Christian 
Info JOURNAL OF MOLECULAR STRUCTURE, (2017), vol. 1127 br. , str. 427-436
Projekat Deanship of Scientific Research at King Saud University [PRG-1436-23]; Schrodinger Inc.
Ispravka ISI/Web of Science   Članak   Elečas   Rang časopisa   Citati: ISI/Web of Science   Scopus  
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