Effects of the Level of Electronic Structure Theory on the Dynamics of the F– + CH3I Reaction von Győri, Tibor, Olasz, Balázs, Paragi, Gábor, Czakó, Gábor

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Fluorescence-Labeled Amyloid Beta Monomer: A Molecular Dynamical Study von Gera, János, Paragi, Gábor

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Diatomic molecule in a strong infrared laser field: level-shifts and bond-length change due to laser-dressed Morse potential von Varró, Sándor, Hack, Szabolcs, Paragi, Gábor, Földi, Péter, Barna, Imre F, Czirják, Attila

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Quinone binding site in a type VI sulfide:quinone oxidoreductase von Miklovics, Nikolett, Duzs, Ágnes, Balogh, Fanni, Paragi, Gábor, Rákhely, Gábor, Tóth, András

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Discovering the chloride pathway in the CFTR channel von Farkas, Bianka, Tordai, Hedvig, Padányi, Rita, Tordai, Attila, Gera, János, Paragi, Gábor, Hegedűs, Tamás

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Synthesis and Antiproliferative Activity of Steroidal Diaryl Ethers von Kovács, Édua, Ali, Hazhmat, Minorics, Renáta, Traj, Péter, Resch, Vivien, Paragi, Gábor, Bruszel, Bella, Zupkó, István, Mernyák, Erzsébet

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Insights into the catalytic mechanism of type VI sulfide:quinone oxidoreductases von Duzs, Ágnes, Miklovics, Nikolett, Paragi, Gábor, Rákhely, Gábor, Tóth, András

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Telomere Structure and Stability: Covalency in Hydrogen Bonds, Not Resonance Assistance, Causes Cooperativity in Guanine Quartets von Fonseca Guerra, Célia, Zijlstra, Hester, Paragi, Gábor, Bickelhaupt, F. Matthias

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Cooperativity in the Self‐Assembly of the Guanine Nucleobase into Quartet and Ribbon Structures on Surfaces von Paragi, Gábor, Fonseca Guerra, Célia

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Investigation of the Antineoplastic Effects of 2-(4-Chlorophenyl)-13α-Estrone Sulfamate against the HPV16-Positive Human Invasive Cervical Carcinoma Cell Line SiHa von Ali, Hazhmat, Traj, Péter, Szebeni, Gábor J, Gémes, Nikolett, Resch, Vivien, Paragi, Gábor, Mernyák, Erzsébet, Minorics, Renáta, Zupkó, István

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Cooperative Self-Assembly in Linear ChainsBased on Halogen Bonds von Vermeeren, Pascal, Wolters, Lando P, Paragi, Gábor, Fonseca Guerra, Célia

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Synthesis of Estrone Heterodimers and Evaluation of Their In Vitro Antiproliferative Activity von Bózsity, Noémi, Nagy, Viktória, Szabó, Johanna, Pálházi, Balázs, Kele, Zoltán, Resch, Vivien, Paragi, Gábor, Zupkó, István, Minorics, Renáta, Mernyák, Erzsébet

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A Fragmenting Protocol with Explicit Hydration for Calculation of Binding Enthalpies of Target-Ligand Complexes at a Quantum Mechanical Level von Horváth, István, Jeszenői, Norbert, Bálint, Mónika, Paragi, Gábor, Hetényi, Csaba

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Synthesis and evaluation of anticancer activities of 2- or 4-substituted 3-(N-benzyltriazolylmethyl)-13α-oestrone derivatives von Jójárt, Rebeka, Tahaei, Seyyed Ashkan Senobar, Trungel-Nagy, Péter, Kele, Zoltán, Minorics, Renáta, Paragi, Gábor, Zupkó, István, Mernyák, Erzsébet

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The Impact of Molecular Dynamics Sampling on the Performance of Virtual Screening against GPCRs von Tarcsay, Ákos, Paragi, Gábor, Vass, Márton, Jójárt, Balázs, Bogár, Ferenc, Keserű, György M

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Thermodynamic and kinetic insights into the interaction of kynurenic acid with human serum albumin: Spectroscopic and calorimetric approaches von Hornok, Viktória, Juhász, Ádám, Paragi, Gábor, Kovács, Alexandra N., Csapó, Edit

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A Novel 2-Methoxyestradiol Derivative: Disrupting Mitosis Inhibiting Cell Motility and Inducing Apoptosis in HeLa Cells In Vitro von Njangiru, Isaac Kinyua, Bózsity-Faragó, Noémi, Resch, Vivien Erzsébet, Paragi, Gábor, Frank, Éva, Balogh, György T, Zupkó, István, Minorics, Renáta

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Synthesis, Biological Evaluation and Docking Studies of 13-Epimeric 10-fluoro- and 10-Chloroestra-1,4-dien-3-ones as Potential Aromatase Inhibitors von Jójárt, Rebeka, Traj, Péter, Kovács, Édua, Horváth, Ágnes, Schneider, Gyula, Szécsi, Mihály, Pál, Attila, Paragi, Gábor, Mernyák, Erzsébet

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Synthesis and evaluation of AKR1C inhibitory properties of A-ring halogenated oestrone derivatives von Sinreih, Maša, Jójárt, Rebeka, Kele, Zoltán, Büdefeld, Tomaž, Paragi, Gábor, Mernyák, Erzsébet, Rižner, Tea Lanišnik

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Self-Assembly of N3‑Substituted Xanthines in the Solid State and at the Solid–Liquid Interface von Ciesielski, Artur, Haar, Sébastien, Bényei, Attila, Paragi, Gábor, Guerra, Célia Fonseca, Bickelhaupt, F. Matthias, Masiero, Stefano, Szolomájer, János, Samorì, Paolo, Spada, Gian Piero, Kovács, Lajos

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