Browsing Τμήμα Χημείας / Department of Chemistry by Author "Zeinalipour-Yazdi, Constantinos D."
Now showing items 1-9 of 9
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Article
Analysis of binding parameters of HIV-1 integrase inhibitors: Correlates of drug inhibition and resistance
Loizidou, Eriketi Z.; Zeinalipour-Yazdi, Constantinos D.; Christofides, Tasos C.; Kostrikis, Leondios G. (2009)This study undertook an exploratory data analysis of the binding parameters of HIV-1 integrase inhibitors. The study group involved inhibitors in preclinical development from the diketo acid, pyrroloquinoline and naphthyridine ...
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Article
CO adsorption on transition metal clusters: Trends from density functional theory
Zeinalipour-Yazdi, Constantinos D.; Cooksy, A. L.; Efstathiou, Angelos M. (2008)This work reports for the first time the trends for carbon monoxide (CO) chemisorption on transition metal clusters present in supported metal catalysts. In particular, the energetic, structural and infrared adsorption ...
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Article
Computational Inhibition Studies of the Human Proteasome by Argyrin‐Based Analogues with Subunit Specificity
Loizidou, Eriketi Z.; Zeinalipour-Yazdi, Constantinos D. (2014)
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Article
A diffuse reflectance infrared fourier-transform spectra and density functional theory study of CO adsorption on Rhγ-Al2O 3
Zeinalipour-Yazdi, Constantinos D.; Cooksy, A. L.; Efstathiou, Angelos M. (2007)The vibrational frequencies and bond dissociation energies of carbon monoxide adsorbed to various rhodium clusters are computed, and the diffuse reflectance infrared Fourier-transform (DRIFT) spectrum of carbon monoxide ...
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Article
Implications of HIV-1 M group polymorphisms on integrase inhibitor efficacy and resistance: Genetic and structural in silico analyses
Loizidou, Eriketi Z.; Kousiappa, Ioanna; Zeinalipour-Yazdi, Constantinos D.; Van De Vijver, D. A. M. C.; Kostrikis, Leontios G. (2009)The extensive polymorphisms among HIV-1 subtypes have been implicated in drug resistance development. Integrase inhibitors represent the latest addition to the treatment of HIV-1, and their efficacy and resistance patterns ...
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Article
Linear correlation between binding energy and Young's modulus in graphene nanoribbons
Zeinalipour-Yazdi, Constantinos D.; Christofides, Constantinos (2009)Graphene nanoribbons (GNRs) have been suggested as a promising material for its use as nanoelectromechanical reasonators for highly sensitive force, mass, and charge detection. Therefore the accurate determination of the ...
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Article
Mechanistic aspects of the water-gas shift reaction on alumina-supported noble metal catalysts: In situ DRIFTS and SSITKA-mass spectrometry studies
Olympiou, G. G.; Kalamaras, Christos M.; Zeinalipour-Yazdi, Constantinos D.; Efstathiou, Angelos M. (2007)Steady-state isotopic transient kinetic analysis (SSITKA) experiments coupled with mass spectrometry were performed for the first time to study essential mechanistic aspects of the water-gas shift (WGS) reaction over ...
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Article
Preadsorbed water-promoted mechanism of the water-gas shift reaction
Zeinalipour-Yazdi, Constantinos D.; Efstathiou, Angelos M. (2008)In this work, a detailed first principle study of the mechanism of the heterogeneous catalytic water-gas shift (WGS) reaction on a rhodium cluster is presented. A large number of possible reaction mechanisms relevant to ...
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Book
Proceedings of the Seventh International Workshop on Data Management for Sensor Networks
Zeinalipour-Yazdi, Constantinos D.; ACM, Digital Library (ACM, 2010)