Ήλιος - Αποθετήριο ΕΙΕ: Ινστιτούτο Χημικής Βιολογίας

Ινστιτούτο Χημικής Βιολογίας - Επιστημονικό έργο

Περιλαμβάνονται δημοσιεύσεις σε έγκριτα διεθνή επιστημονικά περιοδικά, εργασίες ερευνητών, πρακτικά συνεδρίων, βιβλία, μονογραφίες, διαλέξεις, εκπαιδευτικό υλικό, ενημερωτικά δελτία, πολυμεσικό υλικό (βίντεο) και ερευνητικά αποτελέσματα.

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Collection's Items (Sorted by Τίτλος in Αύξουσα order): 401 to 420 of 2456

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Ημερομηνία	Τίτλος	Δημιουργός
2014	Computation of nonlinear optical properties of molecules with large amplitude anharmonic motions. III. Arbitrary double-well potentials	Reis H.; Luis J.M.; Garcia-Borràs M.; Kirtman B.
2023	Computational and Enzymatic Studies of Sartans in SARS-CoV-2 Spike RBD-ACE2 Binding: The Role of Tetrazole and Perspectives as Antihypertensive and COVID-19 Therapeutics	Kelaidonis, Konstantinos; Ligielli, Irene; Letsios, Spiros; Vidali, Veroniki P; Mavromoustakos, Thomas; Vassilaki, Niki; Moore, Graham J; Hoffmann, Weronika; Węgrzyn, Katarzyna; Ridgway, Harry; Chasapis, Christos T.; Matsoukas, John M
2008	Computational design of novel fullerene analogues as potential HIV-1 PR inhibitors: Analysis of the binding interactions between fullerene inhibitors and HIV-1 PR residues using 3D QSAR, molecular docking and molecular dynamics simulations	Durdagi, Serdar; Μαυρομούστακος, Θωμάς; Chronakis, Nikos; Παπαδόπουλος, Μάνθος Γ.
2024	Computational Evidence for Bisartan Arginine Blockers as Next-Generation Pan-Antiviral Therapeutics Targeting SARS-CoV-2, Influenza, and Respiratory Syncytial Viruses	Ridgway, Harry; Apostolopoulos, Vasso; Moore, Graham J; Gadanec, Laura Kate; Zulli, Anthony; Swiderski, Jordan; Tsiodras, Sotirios; Kelaidonis, Konstantinos; Chasapis, Christos T.; Matsoukas, John M
2019	A computational pipeline for the extraction of actionable biological information from NGS-phage display experiments	Vekris A.; Pilalis E.; Chatziioannou A.; Petry K.G.
2010	A computational study on cannabinoid receptors and potent bioactive cannabinoid ligands: homology modeling, docking, de novo drug design and molecular dynamics analysis	Durdagi, Serdar; Παπαδόπουλος, Μάνθος Γ.; Ζουμπουλάκης, Παναγιώτης; Koukoulitsa, Catherine; Μαυρομούστακος, Θωμάς
1999	Computer simulation of the linear and nonlinear optical properties of liquid benzene: Its local fields, refractive index, and second nonlinear susceptibility	Janssen, R. H. C.; Bomont, J. M.; Theodorou, D. N.; Raptis, S.; Παπαδόπουλος, Μάνθος Γ.
2005	Computer simulation of the linear and nonlinear optical susceptibilities of p-nitroaniline in cyclohexane, 1,4-dioxane, and tetrahydrofuran in quadrupolar approximation. I. Molecular polarizabilities and hyperpolarizabilities	Ραϊς, Χεριμπέρτ; Grzybowski, A.; Παπαδόπουλος, Μάνθος Γ.
2006	Computer simulation of the linear and nonlinear optical susceptibilities of p-nitroaniline in cyclohexane, 1,4-dioxane, and tetrahydrofuran in quadrupolar approximation. II. Local field effects and optical susceptibilitities	Ραϊς, Χεριμπέρτ; Παπαδόπουλος, Μάνθος Γ.; Grzybowski, A.
2008	Computer-supported angiogenesis quantification using image analysis and statistical averaging	Doukas, Charalampos N.; Maglogiannis, Ilias; Χατζηιωάννου, Αριστοτέλης
1975	Concentration and Substrate Dependent Reaction-Mechanisms in Metal Ketyl-Alkyl Halide System - Magnetochemical Zero-Order Kinetics as Evidence for a Diamagnetic Reactive Species at High Ketyl Concentrations - Catalysis by Transition-Metals	Σκρέττας, Κωνσταντίνος Γ.; Georgiou, D. G.
2005	A concise approach to benzoic acid derivatives bearing an alpha,beta-unsaturated ketone substituent: Synthesis of methyl taboganate	Detsi, A.; Roussis, V.; Tsotinis, A.; Roussakis, C.; Καλογεροπούλου, Θεοδώρα
2004	Conformation and bioactivity. Design and discovery of novel antihypertensive drugs	Μαυρομούστακος, Θωμάς; Ζερβού, Μαρία; Ζουμπουλάκης, Παναγιώτης; Kyrikou, I.; Benetis, N. P.; Polevaya, L.; Roumelioti, P.; Giatas, N.; Zoga, A.; Minakakis, P. M.; Kolocouris, A.; Vlahakos, D.; Grdadolnik, S. G.; Matsoukas, J.
2003	Conformation and bioactivity: design and discovery of novel antihypertensive drugs	Μαυρομούστακος, Θωμάς; Ζερβού, Μαρία; Ζουμπουλάκης, Παναγιώτης; Kyrikou, I.; Roumelioti, P.; Giatas, N.; Zoga, A.; Minakakis, P.M.; Kamoutsis, C.; Dimitriou, D.; Pitsas, A.; Matsoukas, J.
2010	Conformational Analysis of Aliskiren, a Potent Renin Inhibitor, in Solution using NMR and Molecular Dynamics	Matsoukas, M. T.; Ζουμπουλάκης, Παναγιώτης; Tselios, T.
2011	Conformational Analysis of Aliskiren, a Potent Renin Inhibitor, Using High-Resolution Nuclear Magnetic Resonance and Molecular Dynamics Simulations	Matsoukas, Minos-Timotheos; Ζουμπουλάκης, Παναγιώτης; Tselios, Theodore
2007	Conformational analysis of AT1 antagonist valsartan using 2DNMR spectroscopy and computational analysis: determination of thermodynamic parameters through dynamic NMR spectroscopy and semi-empirical calculations	Potamitis, C.; Ραϊς, Χεριμπέρτ; Ζερβού, Μαρία; Παπαδόπουλος, Μάνθος Γ.; Μαυρομούστακος, Θωμάς
1999	Conformational analysis of peptidic and peptidomimetic AII antagonist using a combination of NRM spectroscopy and theoretical calculations	Kolocouris, Antonios; Ζερβού, Μαρία; Μαυρομούστακος, Θωμάς; Roumelioti, Panagiota; Tselios, Theodoros; Matsoukas, John; Humpfer, E.
2011	Conformational analysis of the MBP(83-99) (Phe(91)) and MBP(83-99) (Tyr(91)) peptide analogues and study of their interactions with the HLA-DR2 and human TCR receptors by using Molecular Dynamics	Potamitis, C.; Matsoukas, M. -T.; Tselios, T.; Μαυρομούστακος, Θωμάς; Grdadolnik, S. Golic
1997	Conformational analysis of the thrombin receptor agonist peptides SFLLR and SFLLR-NH2 by NMR: Evidence for a cyclic bioactive conformation	Matsoukas, J.; Hollenberg, M. D.; Μαυρομούστακος, Θωμάς; Panagiotopoulos, D.; Alexopulos, K.; Yamdagni, R.; Wu, Q.; Moore, G. J.

Collection's Items (Sorted by Τίτλος in Αύξουσα order): 401 to 420 of 2456

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Ινστιτούτο Χημικής Βιολογίας - Επιστημονικό έργο

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