Search Results - Demeter Tzeli

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  1. 1

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

    Published in ACS Omega (2025-08-01)
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  2. 2

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

    Published in Molecules (2025-07-01)
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  3. 3

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

    Published in Molecules (2023-04-01)
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  4. 4

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

    Published in Journal of Chemistry (2019-01-01)
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  5. 5

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

    Published in Atoms (2024-12-01)
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  6. 6

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

    Published in Current Issues in Molecular Biology (2024-07-01)
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  7. 7

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

    Published in Inorganics (2024-04-01)
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  8. 8

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

    Published in Molecules (2022-04-01)
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  9. 9

    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 by Constantinos Demetriou, Christina Eleftheria Tzeliou, Alexandros Androutsopoulos, Demeter Tzeli

    Published in Molecules (2023-12-01)
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  10. 10

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

    Published in Molecules (2023-07-01)
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  11. 11

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

    Published in Current Issues in Molecular Biology (2025-08-01)
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  12. 12

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

    Published in Molecules (2024-05-01)
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  13. 13

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

    Published in Molecules (2022-07-01)
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  14. 14

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

    Published in Molecules (2025-03-01)
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  15. 15

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

    Published in Molecules (2022-04-01)
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  16. 16

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

    Published in Pharmaceuticals (2025-01-01)
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  17. 17

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

    Published in ACS Omega (2024-11-01)
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  18. 18

    Losartan Interactions with 2-Hydroxypropyl-β-CD by 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

    Published in Molecules (2022-04-01)
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  19. 19

    Comparative Interaction Studies of Quercetin with 2-Hydroxyl-propyl-β-cyclodextrin and 2,6-Methylated-β-cyclodextrin by Vasiliki Vakali, Michail Papadourakis, Nikitas Georgiou, Nikoletta Zoupanou, Dimitrios A. Diamantis, Uroš Javornik, Paraskevi Papakyriakopoulou, Janez Plavec, Georgia Valsami, Andreas G. Tzakos, Demeter Tzeli, Zoe Cournia, Thomas Mauromoustakos

    Published in Molecules (2022-08-01)
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