31 results on '"Ayoubi‐Chianeh, Mojgan"'
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2. New Hydroxylated Cyclic and Acyclic Silylenes Via DFT
3. A Quest for (sila)0-4cyclopentasilylenes and their Arduengo Analogs by DFT
4. Activation of dihydrogen by group‐14 substituted germylenes
5. Detection of bendamustine anti-cancer drug via AlN and Si-doped C nanocone and nanosheet sensors by DFT
6. Activation of dihydrogen by group‐14 substituted germylenes.
7. Novel silicon super bases at DFT level of theory: effects of fused benzene rings on the basicity of 2,4,6-cycloheptatrienesilylene
8. New pathways of stability for NHCs derived from azole, di-azole, n-tetrazole, and ab-tetrazole, by DFT
9. Revealing a notable interaction in the binding of type II statins to HMG‐CoA reductase: Stacked cation–π interaction
10. Cyclic and linear germylenes as ligands: DFT study
11. Revealing a novel and notable interaction in the binding of type II statins to HMG-CoA reductase: Stacked cation–π interaction
12. Inclusion complexes of atorvastatin calcium ( ATV‐Ca ) and rosuvastatin calcium ( ROV‐Ca ) drugs withα ‐CD,β ‐CD,γ ‐CD,HP‐ β ‐CD,M‐ β ‐CD, and maltodextrin along with their characterizations through experimental and computational methods
13. Inclusion complexes of atorvastatin calcium (ATV‐Ca) and rosuvastatin calcium (ROV‐Ca) drugs with α‐CD, β‐CD, γ‐CD, HP‐β‐CD, M‐β‐CD, and maltodextrin along with their characterizations through experimental and computational methods
14. Theoretical study of the electronic features of Silicon-Carbon crystal as a semiconductor using Quantum Espresso
15. Theoretical study of new promising conjugated psoralens in psoralen ultraviolet A therapy
16. Stable four‐membered cyclosilylenes at theoretical levels
17. New Hydroxylated Cyclic and Acyclic Silylenes Via DFT
18. Theoretical study of new promising conjugated psoralens in psoralen ultraviolet A therapy.
19. Gold at crossroads of radical generation and scavenging at density functional theory level: Nitrogen and oxygen free radicals versus their precursors in the face of nanogold
20. Novel silylphenol antioxidants by density functional theory
21. New monodentate and bidentate silylene ligands byDFT
22. A Quest for (sila)0-4cyclopentasilylenes and their Arduengo Analogs by DFT
23. Novel triplet silavinylidenes via density functional theory
24. Novel halogenated cyclopentasilylene‐2,4‐dienes via DFT
25. Stable four‐membered cyclosilylenes at theoretical levels.
26. Silicon photosensitizers in cancer therapy: Theoretical studies on novel 5‐methoxypsoralens
27. Toward triplet disilavinylidenes: A Hammett electronic survey for substituent effects on singlet‐triplet energy gaps of silylenes by DFT
28. Nucleophilicity of cyclic conjugated silylenes using DFT method
29. Gold at crossroads of radical generation and scavenging at density functional theory level: Nitrogen and oxygen free radicals versus their precursors in the face of nanogold.
30. A new route to π-extended polycyclic aromatic hydrocarbons via cross-dehydrogenative coupling
31. A new route to π-extended polycyclic aromatic hydrocarbons viacross-dehydrogenative couplingElectronic supplementary information (ESI) available. See DOI: 10.1039/c7cy01040k
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