نتائج البحث - Demeter Tzeli

Electronic Structure and Chemical Bonding of MoX Molecules, where X = Li, Be, B, C, N, O, and F حسب Alexandros Androutsopoulos, Demeter Tzeli

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Electronic Structure of the Ground and Low-Lying States of MoLi حسب Constantinos Demetriou, Demeter Tzeli

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Metallocene-Naphthalimide Derivatives: The Effect of Geometry, DFT Methodology, and Transition Metals on Absorption Spectra حسب Christina Eleftheria Tzeliou, Demeter Tzeli

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Physical Insights into Molecular Sensors, Molecular Logic Gates, and Photosensitizers in Photodynamic Therapy حسب Demeter Tzeli, Ioannis D. Petsalakis

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A Critical Look at Density Functional Theory in Chemistry: Untangling Its Strengths and Weaknesses حسب Konstantinos P. Zois, Demeter Tzeli

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Similarities and Differences on the Electronic Structure and Chemical Bonding of Isoelectronic Molecules: X2NH and HNX2NH, where X = N and C– حسب Georgios A. Tsekouras, Demeter Tzeli

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Docking, MD Simulations, and DFT Calculations: Assessing W254’s Function and Sartan Binding in Furin حسب Nikitas Georgiou, Thomas Mavromoustakos, Demeter Tzeli

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Molecular Logic Gates Based on Ferrocene-Containing Compounds حسب Christina Eleftheria Tzeliou, Konstantinos P. Zois, Demeter Tzeli

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Computational Investigation of Ionization Energies and Absorption Spectra of Metallocenes: Effect of the Metal Center on Electronic Properties حسب Christina Eleftheria Tzeliou, Konstantinos P. Zois, Demeter Tzeli

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Review on the QM/MM Methodologies and Their Application to Metalloproteins حسب Christina Eleftheria Tzeliou, Markella Aliki Mermigki, Demeter Tzeli

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Electronic Structure and Chemical Bonding of the First-, Second-, and Third-Row-Transition-Metal Monoborides: The Formation of Quadruple Bonds in RhB, RuB, and TcB حسب Constantinos Demetriou, Christina Eleftheria Tzeliou, Alexandros Androutsopoulos, Demeter Tzeli

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Photoswitchable Molecular Units with Tunable Nonlinear Optical Activity: A Theoretical Investigation حسب Aggelos Avramopoulos, Heribert Reis, Demeter Tzeli, Robert Zaleśny, Manthos G. Papadopoulos

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Conformational and Functional Properties of the Bioactive Thiosemicarbazone and Thiocarbohydrazone Compounds حسب Nikitas Georgiou, Ektoras Vasileios Apostolou, Stamatia Vassiliou, Demeter Tzeli, Thomas Mavromoustakos

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Synthesis of Thiazolidin-4-Ones Derivatives, Evaluation of Conformation in Solution, Theoretical Isomerization Reaction Paths and Discovery of Potential Biological Targets حسب Nikitas Georgiou, Danai Karta, Antigoni Cheilari, Franci Merzel, Demeter Tzeli, Stamatia Vassiliou, Thomas Mavromoustakos

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Conformational Properties and Putative Bioactive Targets for Novel Thiosemicarbazone Derivatives حسب Nikitas Georgiou, Antigoni Cheilari, Danai Karta, Eleni Chontzopoulou, Janez Plavec, Demeter Tzeli, Stamatia Vassiliou, Thomas Mavromoustakos

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Spectroscopic Characterization Using ¹H and ¹³C Nuclear Magnetic Resonance and Computational Analysis of the Complex of Donepezil with 2,6-Methyl-β-Cyclodextr... حسب Nikoletta Zoupanou, Paraskevi Papakyriakopoulou, Nikitas Georgiou, Antigoni Cheilari, Uroš Javornik, Peter Podbevsek, Demeter Tzeli, Georgia Valsami, Thomas Mavromoustakos

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Conformational Properties of New Thiosemicarbazone and Thiocarbohydrazone Derivatives and Their Possible Targets حسب Nikitas Georgiou, Aikaterini Katsogiannou, Dimitrios Skourtis, Hermis Iatrou, Demeter Tzeli, Stamatia Vassiliou, Uroš Javornik, Janez Plavec, Thomas Mavromoustakos

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Synthesis of Anti-Inflammatory Drugs’ Chalcone Derivatives and a Study of Their Conformational Properties Through a Combination of Nuclear Magnetic Resonance Spectroscopy and Molec... حسب Nikitas Georgiou, Andromachi Tzani, Kyriaki Vavougyiou, Christos Papadopoulos, Nikolaos Eleftheriadis, Primož Šket, Demeter Tzeli, Tuomas Niemi-Aro, Anastasia Detsi, Thomas Mavromoustakos

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Exploring Hypertension: The Role of AT1 Receptors, Sartans, and Lipid Bilayers حسب Nikitas Georgiou, Eleni Chontzopoulou, Efthymios Alexandros Routsi, Irene Georgia Stavrakaki, Errikos Petsas, Nikoletta Zoupanou, Margarita Georgia Kakava, Demeter Tzeli, Thomas Mavromoustakos, Sofia Kiriakidi

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Losartan Interactions with 2-Hydroxypropyl-β-CD حسب Vasiliki Palli, Georgios Leonis, Nikoletta Zoupanou, Nikitas Georgiou, Maria Chountoulesi, Nikolaos Naziris, Demeter Tzeli, Costas Demetzos, Georgia Valsami, Konstantinos D. Marousis, Georgios A. Spyroulias, Thomas Mavromoustakos

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