Showing results 2 to 7 of 7
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| Issue Date | Title | Author(s) |
| 15-May-2017 | 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 | Ranjith P.; Al-Abdullah E.; Al-Omary F.; El-Emam A.; Anto P.; Sheena M.; Armaković, Stevan; Armaković, Stevan; Zitko J.; Dolezal M.; Van Alsenoy C. |
| 5-Aug-2017 | 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 | Mary Y.; Al-Omary F.; Mostafa G.; El-Emam A.; Manjula P.; Sarojini B.; Narayana B.; Armaković, Stevan; Armaković, Stevan; Van Alsenoy C. |
| 5-Jan-2017 | 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 | Al-Omary F.; Mary Y.; Beegum S.; Panicker C.; Al-Shehri M.; El-Emam A.; Armaković, Stevan; Armaković, Stevan; Van Alsenoy C. |
| 15-Jan-2017 | Reactive, spectroscopic and antimicrobial assessments of 5-[(4-methylphenyl) acetamido]-2-(4-tert-butylphenyl)benzoxazole: Combined experimental and computational study | Mary Y.; Alzoman N.; Menon V.; Al-Abdullah E.; El-Emam A.; Panicker C.; Temiz-Arpaci O.; Armaković, Stevan; Armaković, Stevan; Van Alsenoy C. |
| 15-Jul-2018 | Synthesis, spectroscopic analyses, chemical reactivity and molecular docking study and anti-tubercular activity of pyrazine and condensed oxadiazole derivatives | Al-Tamimi A.; Mary Y.; Miniyar P.; Al-Wahaibi L.; El-Emam A.; Armaković, Stevan; Armaković, Stevan |
| 5-Apr-2017 | Synthesis, vibrational spectroscopic investigations, molecular docking, antibacterial studies and molecular dynamics study of 5-[(4-nitrophenyl)acetamido]-2-(4-tert-butylphenyl)benzoxazole | Sheena Mary Y.; Al-Shehri M.; Jalaja K.; Al-Omary F.; El-Emam A.; Yohannan Panicker C.; Armaković, Stevan; Armaković, Stevan; Temiz-Arpaci O.; Van Alsenoy C. |