818 results on '"Mavromoustakos, Thomas"'
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2. Density functional theory and enzyme studies support interactions between angiotensin receptor blockers and angiotensin converting enzyme-2: Relevance to coronavirus 2019
3. Computational and spectroscopic analysis of the Quercetin encapsulation in (2HP-β-CD)2 and (2,6Me-β-CD)2 complexes
4. Are Terminal Alkynes Necessary for MAO-A/MAO-B Inhibition? A New Scaffold Is Revealed
5. Synthesis of Thiazolidin-4-Ones Derivatives, Evaluation of Conformation in Solution, Theoretical Isomerization Reaction Paths and Discovery of Potential Biological Targets
6. Molecular interactions of hesperidin with DMPC/cholesterol bilayers
7. Insights into molecular mechanism of action of citrus flavonoids hesperidin and naringin on lipid bilayers using spectroscopic, calorimetric, microscopic and theoretical studies
8. Docking, MD Simulations, and DFT Calculations: Assessing W254's Function and Sartan Binding in Furin.
9. Discovery of a new generation of angiotensin receptor blocking drugs: Receptor mechanisms and in silico binding to enzymes relevant to SARS-CoV-2
10. Effects of cholesterol on the GPCR AT1 receptor and its interplay with AT1 antagonists
11. Contributors
12. Interplay of cholesterol, membrane bilayers and the AT1R: A cholesterol consensus motif on AT1R is revealed
13. Structure–function analysis of naturally occurring apolipoprotein A-I L144R, A164S and L178P mutants provides insight on their role on HDL levels and cardiovascular risk
14. Effects of Cholesterol on GPCR Function: Insights from Computational and Experimental Studies
15. Drug-Membrane Interactions in the Renin Angiotensin System
16. Exploring the Binding Effects of Natural Products and Antihypertensive Drugs on SARS-CoV-2: An In Silico Investigation of Main Protease and Spike Protein
17. The dynamic properties of angiotensin II type 1 receptor inverse agonists in solution and in the receptor site
18. Discovery of a stable tripeptide targeting the N-domain of CRF1 receptor
19. Ligand–Receptor Interactions and Drug Design
20. Novel benzimidazole angiotensin receptor blockers with anti-SARS-CoV-2 activity equipotent to that of nirmatrelvir: computational and enzymatic studies
21. DIFFERENTIAL SCANNING CALORIMETRY: A SUITABLE METHODOLOGY TO PROBLEM THE BINDING PROPERTIES OF BCL-2 INHIBITORS
22. Differential Scanning Calorimetry (DSC) on Sartan/Cyclodextrin Delivery Formulations
23. Applications of NMR in Drug:Cyclodextrin Complexes
24. 2D DOSY NMR: A Valuable Tool to Confirm the Complexation in Drug Delivery Systems
25. Drug Incorporation in the Drug Delivery System of Micelles
26. Study of Candesartan Cilexetil: 2-Hydroxypropyl-β-Cyclodextrin Interactions: A Computational Approach Using Steered Molecular Dynamics Simulations
27. Application of Neutralization and Freeze-Drying Technique for the Preparation of the Beneficial in Drug Delivery 2-Hydroxypropyl-β-Cyclodextrin Complexes with Bioactive Molecules
28. Association of the Thermodynamics with the Functionality of Thermoresponsive Chimeric Nanosystems
29. Unveiling the Thermodynamic Aspects of Drug-Cyclodextrin Interactions Through Isothermal Titration Calorimetry
30. Drug Delivery Systems Based on Modified Polysaccharides: Synthesis and Characterization
31. Molecular Dynamics Protocols for the Study of Cyclodextrin Drug Delivery Systems
32. A Differential Scanning Calorimetry (DSC) Experimental Protocol for Evaluating the Modified Thermotropic Behavior of Liposomes with Incorporated Guest Molecules
33. Discovery of selective dengue virus inhibitors using combination of molecular fingerprint-based virtual screening protocols, structure-based pharmacophore model development, molecular dynamics simulations and in vitro studies
34. Binding Conformation of 2-Oxoamide Inhibitors to Group IVA Cytosolic Phospholipase A2 Determined by Molecular Docking Combined with Molecular Dynamics
35. Potent Lipophilic Melatoninergic x-fluoro-y-methoxy Substituted Phenylalkylamides: Molecular Dynamics Calculations and in vitro Modified Release in Aqueous Media from Tablet Formulations
36. Network-Based Prediction of Side Effects of Repurposed Antihypertensive Sartans against COVID-19 via Proteome and Drug-Target Interactomes
37. 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
38. The use of J-coupling as a sole criterion to assign the total absolute stereochemistry of new pyrrolidinone class synthetic analogs, derived from S-pyroglutamic acid
39. Chapter 5 - Peptide-based vaccines and altered peptide ligands: Multiple sclerosis paving the way
40. Quercetin: A Potential Polydynamic Drug.
41. CoMFA and CoMSIA 3D-Quantitative Structure-Activity Relationships of New Flexible Antileishmanial Ether Phospholipids
42. Vinblastine
43. Thiocarbohydrazone and Chalcone-Derived 3,4-Dihydropyrimidinethione as Lipid Peroxidation and Soybean Lipoxygenase Inhibitors
44. Curcumin-Loaded PnBA-b-POEGA Nanoformulations: A Study of Drug-Polymer Interactions and Release Behavior
45. Exploring new scaffolds for angiotensin II receptor antagonism
46. Mapping the interactions and bioactivity of quercetin⿿(2-hydroxypropyl)-β-cyclodextrin complex
47. Development of a potent 2-oxoamide inhibitor of secreted phospholipase A2 guided by molecular docking calculations and molecular dynamics simulations
48. Elucidation of the binding mechanism of renin using a wide array of computational techniques and biological assays
49. Designing Natural Product Hybrids Bearing Triple Antiplatelet Profile and Evaluating Their Human Plasma Stability
50. Molecular Dynamics Simulations on the Bioactive Molecule of hIAPP22–29 (NFGAILSS) and Rational Drug Design
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