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List of works by Thomas Mavromoustakos

1H NMR-Based Protocol for the Detection of Adulterations of Refined Olive Oil with Refined Hazelnut Oil

2D NMR and conformational analysis of a prototype anti-tumour steroidal ester

scientific article published on 17 February 2005

3D QSAR CoMFA/CoMSIA, molecular docking and molecular dynamics studies of fullerene-based HIV-1 PR inhibitors.

scientific article

3D QSAR/CoMFA and CoMSIA studies on antileukemic steroidal esters coupled with conformationally flexible nitrogen mustards.

scientific article published on November 2008

3D-Quantitative structure-activity relationships of synthetic antileishmanial ring-substituted ether phospholipids

scientific article published on 14 November 2006

A Comparative Molecular Dynamics, MM-PBSA and Thermodynamic Integration Study of Saquinavir Complexes with Wild-Type HIV-1 PR and L10I, G48V, L63P, A71V, G73S, V82A and I84V Single Mutants.

scientific article published on 20 February 2013

A Journey to the Conformational Analysis of T-Cell Epitope Peptides Involved in Multiple Sclerosis

scientific article published on 08 June 2020

A combined NMR and molecular dynamics simulation study to determine the conformational properties of agonists and antagonists against experimental autoimmune encephalomyelitis.

scientific article

A comparative study of the effects of cholesterol and sclareol, a bioactive labdane type diterpene, on phospholipid bilayers

scientific article published on 18 November 2004

A computational study on cannabinoid receptors and potent bioactive cannabinoid ligands: homology modeling, docking, de novo drug design and molecular dynamics analysis.

scientific article

A novel synthetic luteinizing hormone-releasing hormone (LHRH) analogue coupled with modified β-cyclodextrin: insight into its intramolecular interactions

scientific article published on 24 October 2014

A putative bioactive conformation for the altered peptide ligand of myelin basic protein and inhibitor of experimental autoimmune encephalomyelitis [Arg91, Ala96] MBP87-99.

scientific article published on 28 November 2005

AT1 antagonists: a patent review (2008 - 2012).

scientific article published on 23 August 2013

Advancing the Therapeutic Efficacy of Bioactive Molecules by Delivery Vehicle Platforms

scientific article published on 05 June 2020

Amphipathic interactions of cannabinoids with membranes. A comparison between delta 8-THC and its O-methyl analog using differential scanning calorimetry, X-ray diffraction and solid state 2H-NMR.

scientific article

An Efficient Disinfectant, Composite Material {SLS@[Zn3(CitH)2]} as Ingredient for Development of Sterilized and Non Infectious Contact Lens

scientific article published on 07 November 2019

An Overview on Target-Based Drug Design against Kinetoplastid Protozoan Infections: Human African Trypanosomiasis, Chagas Disease and Leishmaniases

scientific article published in 2021

An efficient synthesis of a rationally designed 1,5 disubstituted imidazole AT(1) angiotensin II receptor antagonist: reorientation of imidazole pharmacophore groups in losartan reserves high receptor affinity and confirms docking studies

scientific article published on 10 July 2010

An effort to discover the preferred conformation of the potent AMG3 cannabinoid analog when reaching the active sites of the cannabinoid receptors

scientific article published on 15 October 2011

Antagonistic Effects of Human Cyclic MBP87-99Altered Peptide Ligands in Experimental Allergic Encephalomyelitis and Human T-Cell Proliferation

article

Antihypertensive activity and molecular interactions of irbesartan in complex with 2-hydroxypropyl-β-cyclodextrin

scientific article published on 01 July 2020

Antihypertensive drug valsartan in solution and at the AT1 receptor: conformational analysis, dynamic NMR spectroscopy, in silico docking, and molecular dynamics simulations

scientific article published in March 2009

Antileishmanial ring-substituted ether phospholipids

scientific article published in February 2003

Application of 3D QSAR CoMFA/CoMSIA and in silico docking studies on novel renin inhibitors against cardiovascular diseases.

scientific article published on 8 April 2009

Authenticity of the Traditional Cypriot Spirit “Zivania” on the Basis of1H NMR Spectroscopy Diagnostic Parameters and Statistical Analysis

scientific article published on 01 June 2005

Authenticity of the traditional cypriot spirit "zivania" on the basis of metal content using a combination of coupled plasma spectroscopy and statistical analysis.

scientific article

Binding conformation of 2-oxoamide inhibitors to group IVA cytosolic phospholipase A2 determined by molecular docking combined with molecular dynamics

scientific article published on 10 January 2012

Binding of novel fullerene inhibitors to HIV-1 protease: insight through molecular dynamics and molecular mechanics Poisson-Boltzmann surface area calculations

scientific article published on 04 October 2011

Biocompatible PEO-b-PCL Nanosized Micelles as Drug Carriers: Structure and Drug-Polymer Interactions

scientific article published on 18 September 2020

Biological activity of myricetin and its derivatives against human leukemic cell lines in vitro

scientific article published on 01 November 2000

Branched-chain sugar nucleosides: stereocontrolled synthesis and bioevaluation of novel 3'-C-trifluoromethyl and 3'-C-methyl pyranonucleosides

scientific article

Charting the structural and thermodynamic determinants in phenolic acid natural product - cyclodextrin encapsulations

scientific article published on 06 April 2020

Cheminformatics and virtual screening studies of COMT inhibitors as potential Parkinson's disease therapeutics

scientific article published on 20 November 2019

Combined 3D QSAR and molecular docking studies to reveal novel cannabinoid ligands with optimum binding activity

scientific article

Comparative Binding Effects of Aspirin and Anti-Inflammatory Cu Complex in the Active Site of LOX-1

scientific article published on 15 November 2012

Comparative biophysical studies of sartan class drug molecules losartan and candesartan (CV-11974) with membrane bilayers

scientific article

Comparative docking studies of labdane-type diterpenes with forskolin at the active site of adenylyl cyclase

scientific article published on 26 July 2008

Comparative molecular dynamics simulations of the potent synthetic classical cannabinoid ligand AMG3 in solution and at binding site of the CB1 and CB2 receptors

scientific article published on 14 June 2008

Comparative study of interactions of aliskiren and AT1 receptor antagonists with lipid bilayers. ⬇️

scientific article published on 19 December 2014

Comparative study of the AT₁ receptor prodrug antagonist candesartan cilexetil with other sartans on the interactions with membrane bilayers

scientific article published on 18 August 2012

Comparison of Proposed Putative Active Conformations of Myelin Basic Protein Epitope 87−99 Linear Altered Peptide Ligands by Spectroscopic and Modelling Studies: The Role of Positions 91 and 96 in T-Cell Receptor Activation

scientific article published on 01 November 2006

Comparison of classical and ultrasound-assisted isolation procedures of cellulose from kenaf (Hibiscus cannabinus L.) and eucalyptus (Eucalyptus rodustrus Sm.).

scientific article published on 01 January 2002

Comparison of thermal effects of stilbenoid analogs in lipid bilayers using differential scanning calorimetry and molecular dynamics: correlation of thermal effects and topographical position with antioxidant activity

scientific article published on 08 May 2011

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

scientific article published on 22 October 2008

Conformation and bioactivity. Design and discovery of novel antihypertensive drugs

scientific article published on January 2004

Conformational Properties and Energetic Analysis of Aliskiren in Solution and Receptor Site

scientific article published on 01 December 2011

Conformational analysis of the thrombin receptor agonist peptides SFLLR and SFLLR-NH2 by NMR: evidence for a cyclic bioactive conformation

scientific article published on 01 February 1997

Conformational analysis of the ΜΒΡ83-99 (Phe91) and ΜΒΡ83-99 (Tyr91) peptide analogues and study of their interactions with the HLA-DR2 and human TCR receptors by using molecular dynamics

scientific article published on 06 September 2011

Conformational analysis of two novel cytotoxic C2-substituted pyrrolo[2,3-f]quinolines in aqueous media, organic solvents, membrane bilayers and at the putative active site.

scientific article

Conformational and biological studies for a pair of novel synthetic AT1 antagonists: stereoelectronic requirements for antihypertensive efficacy

scientific article published in April 2003

Copolymerization of Norbornene and Norbornadiene Using a cis-Selective Bimetallic W-Based Catalytic System.

scientific article

Corrigendum to “Thermal, dynamic and structural properties of drug AT1 antagonist olmesartan in lipid bilayers” [Biochim. Biophys. Acta 1808 (2011) 2995–3006]

scientific article published in May 2012

Current Status and Future Prospects of Small-molecule Protein-protein Interaction (PPI) Inhibitors of Tumor Necrosis Factor (TNF) and Receptor Activator of NF-κB Ligand (RANKL)

scientific article published on 01 January 2018

Design and synthesis of a novel potent myelin basic protein epitope 87-99 cyclic analogue: enhanced stability and biological properties of mimics render them a potentially new class of immunomodulators.

scientific article published on March 2005

Design and synthesis of a potent cyclic analogue of the myelin basic protein epitope MBP72-85: importance of the Ala81 carboxyl group and of a cyclic conformation for induction of experimental allergic encephalomyelitis

scientific article published in April 1999

Design and synthesis of novel antihypertensive drugs

scientific article published on 01 May 2003

Design and synthesis of novel biologically active thrombin receptor non-peptide mimetics based on the pharmacophoric cluster Phe/Arg/NH2 of the Ser42-Phe-Leu-Leu-Arg46 motif sequence: platelet aggregation and relaxant activities

scientific article published in June 2004

Design and synthesis of thrombin receptor-derived nonpeptide mimetics utilizing a piperazine scaffold

scientific article published in June 1999

Design of new secreted phospholipase A2 inhibitors based on docking calculations by modifying the pharmacophore segments of the FPL67047XX inhibitor

scientific article published on 4 February 2010

Design, synthesis and biological evaluation of cyclic angiotensin II analogues with 3,5 side-chain bridges. Role of C-terminal aromatic residue and ring cluster for activity and implications in the drug design of AT1 non-peptide antagonists

scientific article published in September 2002

Design, synthesis, and modeling of novel cyclic thrombin receptor-derived peptide analogues of the Ser42-Phe-Leu-Leu-Arg46 motif sequence with fixed conformations of pharmacophoric groups: importance of a Phe/Arg/NH2 cluster for receptor activation

scientific article published on 01 February 2001

Design, synthesis, and molecular modeling of a novel amide-linked cyclic GnRH analogue cyclo(4-9)[Lys4,D-Trp6,Glu9]GnRH: stimulation of gonadotropin gene expression

scientific article published on 01 January 2006

Determination of uronic acids in isolated hemicelluloses from kenaf using diffuse reflectance infrared fourier transform spectroscopy (DRIFTS) and the curve-fitting deconvolution method

scientific article published on 01 February 2004

Development of a CP 31P NMR broadline simulation methodology for studying the interactions of antihypertensive AT1 antagonist losartan with phospholipid bilayers

scientific article published on March 2009

Development of a Predictive Pharmacophore Model and a 3D-QSAR Study for an in silico Screening of New Potent Bcr-Abl Kinase Inhibitors

scientific article published on January 2017

Development of accurate binding affinity predictions of novel renin inhibitors through molecular docking studies

scientific article

Differential membrane fluidization by active and inactive cannabinoid analogues

scientific article published in June 2001

Docking and Molecular Dynamics Calculations of Pyrrolidinone Analog MMK16 Bound to COX and LOX Enzymes.

scientific article

Dual inhibitors for aspartic proteases HIV-1 PR and renin: advancements in AIDS-hypertension-diabetes linkage via molecular dynamics, inhibition assays, and binding free energy calculations

scientific article published on 18 June 2012

Effects of cannabinoids in membrane bilayers containing cholesterol.

scientific article published in August 1999

Effects of non-steroid anti-inflammatory drugs in membrane bilayers

scientific article published in December 2004

Effects of the anesthetic steroid alphaxalone and its inactive delta 16-analog on the thermotropic properties of membrane bilayers. A model for membrane perturbation

scientific article published in November 1995

Elucidation of the binding mechanism of renin using a wide array of computational techniques and biological assays

scientific article published on 25 September 2015

Ether phospholipid-AZT conjugates possessing anti-HIV and antitumor cell activity. Synthesis, conformational analysis, and study of their thermal effects on membrane bilayers

scientific article

Exploiting ChEMBL database to identify indole analogs as HCV replication inhibitors

scientific article published on 27 March 2014

Facile and efficient syntheses of a series of N-benzyl and N-biphenylmethyl substituted imidazole derivatives based on (E)-urocanic acid, as angiotensin II AT1 receptor blockers.

scientific article published on 27 June 2013

Functional Components of Carob Fruit: Linking the Chemical and Biological Space

scientific article

Hematocrit-lowering effect following inactivation of renin-angiotensin system with angiotensin converting enzyme inhibitors and angiotensin receptor blockers.

scientific article published on January 2004

Hypertension study in anaesthetized rabbits: protocol proposal for AT1 antagonists screening.

scientific article published on 31 March 2010

In silico drug screening approach for the design of magic bullets: a successful example with anti-HIV fullerene derivatized amino acids

scientific article

In-vitro cytotoxic/cytostatic activity of anionic liposomes containing vinblastine against leukaemic human cell lines

scientific article published in February 2002

Inhibition of secreted phospholipases A₂ by 2-oxoamides based on α-amino acids: Synthesis, in vitro evaluation and molecular docking calculations.

scientific article

Insights into the molecular basis of action of the AT1 antagonist losartan using a combined NMR spectroscopy and computational approach

scientific article

Interactions at the bilayer interface and receptor site induced by the novel synthetic pyrrolidinone analog MMK3.

scientific article published on 17 November 2009

Interactions of the AT1 antagonist valsartan with dipalmitoyl-phosphatidylcholine bilayers

scientific article published on 18 February 2011

Interactions of the dipeptide paralysin beta-Ala-Tyr and the aminoacid Glu with phospholipid bilayers

scientific article

Interactions of the potent synthetic AT1 antagonist analog BV6 with membrane bilayers and mesoporous silicate matrices

scientific article published on 16 March 2013

Investigation of the Interactions of Silibinin with 2-Hydroxypropyl-β-cyclodextrin through Biophysical Techniques and Computational Methods

scientific article published on 19 February 2015

Losartan's affinity to fluid bilayers modulates lipid-cholesterol interactions

scientific article published on 6 March 2012

Losartan's molecular basis of interaction with membranes and AT1 receptor.

scientific article published in September 2003

Mapping the interactions and bioactivity of quercetin-(2-hydroxypropyl)-β-cyclodextrin complex.

scientific article published on 6 July 2016

Methodologies and applied strategies in the rational drug design

scientific article published on 01 January 2011

Molecular Dynamics Simulations of Angiotensin II in Aqueous and Dimethyl Sulfoxide Environments

article

Molecular Modeling on Pyrimidine-Urea Inhibitors of TNF-α Production: An Integrated Approach Using a Combination of Molecular Docking, Classification Techniques, and 3D-QSAR CoMSIA ⬇️

scientific article published on March 15, 2012

Molecular docking and 3D-QSAR CoMFA studies on indole inhibitors of GIIA secreted phospholipase A(2).

scientific article published on September 2010

Molecular dynamics at the receptor level of immunodominant myelin basic protein epitope 87–99 implicated in multiple sclerosis and its antagonists altered peptide ligands: Triggering of immune response

article

Molecular requirements involving the human platelet protease-activated receptor-4 mechanism of activation by peptide analogues of its tethered-ligand

scientific article

Mononuclear titanium(IV)-citrate complexes from aqueous solutions: pH-specific synthesis and structural and spectroscopic studies in relevance to aqueous titanium(IV)-citrate speciation

scientific article published in April 2005

Monounsaturated fatty acid ether oligomers formed during heating of virgin olive oil show agglutination activity against human red blood cells

scientific article published on 17 January 2014

Novel 17beta-substituted conformationally constrained neurosteroids that modulate GABA A receptors

scientific article published in August 2005

Nuclear magnetic resonance spectral analysis and conformational properties of 11-benzoyl-9,9a,10,11-tetrahydro-4H-indolo[4,3-ab]carbazole

scientific article published on 01 January 1998

On the Rational Drug Design for Hypertension through NMR Spectroscopy

scientific article published on 22 December 2020

Pharmaceutical compositions for antihypertensive treatments: a patent review

scientific article published on 10 September 2015

Putative bioactive conformations of amide linked cyclic myelin basic protein peptide analogues associated with experimental autoimmune encephalomyelitis

scientific article published on 3 November 2007

Quantitative Nanostructure-Activity Relationship Models for the Risk Assessment of NanoMaterials

Quantitative Nanostructure-Activity Relationship Models for the Risk Assessment of NanoMaterials

scientific article published in 2017

Quantitative Nanostructure-Activity Relationship Models for the Risk Assessment of NanoMaterials

Rational design and structure-activity relationship studies of quercetin-amino acid hybrids targeting the anti-apoptotic protein Bcl-xL.

scientific article published on 13 September 2017

Rational design, efficient syntheses and biological evaluation of N,N'-symmetrically bis-substituted butylimidazole analogs as a new class of potent Angiotensin II receptor blockers

scientific article published on 2 January 2013

Rational drug design and synthesis of molecules targeting the angiotensin II type 1 and type 2 receptors

scientific article

Searching for Novel Janus Kinase-2 Inhibitors Using a Combination of Pharmacophore Modeling, 3D-QSAR Studies and Virtual Screening

scientific article published on 19 September 2016

Searching for anthranilic acid-based thumb pocket 2 HCV NS5B polymerase inhibitors through a combination of molecular docking, 3D-QSAR and virtual screening

scientific article published on 10 June 2015

Silver Nanoparticles from Oregano Leaves’ Extracts as Antimicrobial Components for Non-Infected Hydrogel Contact Lenses

scientific article published in 2021

Small angle X-ray diffraction and differential scanning calorimetric studies on O-methyl-(-)-delta 8-tetrahydrocannabinol and its 5' iodinated derivative in membrane bilayers

scientific article published on 01 July 1995

Small angle X-ray diffraction studies of (-)-delta 8-tetrahydrocannabinol and its O-methyl analog in membranes

scientific article published on 01 January 1993

Small angle x-ray diffraction studies on the topography of cannabinoids in synaptic plasma membranes

scientific article published in November 1991

Stability and binding effects of silver(I) complexes at lipoxygenase-1

Static CP 31P NMR multilamellar bilayer broadlines in the absence and presence of the bioactive dipeptide β-Ala-Tyr or Glu

Strategies in the Rational Drug Design ⬇️

scientific article published on January 1, 2011

Structural comparison between type I and type II antagonists: possible implications in the drug design of AT1 antagonists

scientific article published on 01 April 2000

Structural elucidation and conformational properties of the immunomodulator linomide

scientific article published on 01 January 1998

Structural elucidation and conformational properties of the toxin paralysin beta-Ala-Tyr

scientific article published in March 2003

Structural-functional analysis of the third transmembrane domain of the corticotropin-releasing factor type 1 receptor: role in activation and allosteric antagonism

scientific article

Structure elucidation and conformational properties of a novel bioactive clerodane diterpene using a combination of high field NMR spectroscopy, computational analysis and X-ray diffraction

scientific article

Structure elucidation and conformational properties of eprosartan, a non peptide angiotensin II AT1 antagonist.

scientific article published in April 2002

Structure elucidation and conformational properties of synthetic cannabinoids (-)-2-(6a,7,10,10a-tetrahydro-6,6,9-trimethyl-1-hydroxy-6H-dibe nzo [b,d]pyranyl)-2-hexyl-1,3-dithiolane and its methylated analog.

scientific article

Structure elucidation and conformational study of V8: a novel synthetic non peptide AT(1) antagonist.

scientific article published on 2 November 2005

Studies on the thermotropic effects of cannabinoids on phosphatidylcholine bilayers using differential scanning calorimetry and small angle X-ray diffraction

scientific article published on 01 June 1996

Study of the topography of cannabinoids in model membranes using X-ray diffraction

scientific article published on 01 May 1990

Synthesis and contractile activities of cyclic thrombin receptor-derived peptide analogues with a Phe-Leu-Leu-Arg motif: importance of the Phe/Arg relative conformation and the primary amino group for activity

scientific article published on 01 August 1996

Synthesis and spectroscopic and structural studies of a new cadmium(II)-citrate aqueous complex. Potential relevance to cadmium(II)-citrate speciation and links to cadmium toxicity.

scientific article

Synthesis and study of a cyclic angiotensin II antagonist analogue reveals the role of pi*--pi* interactions in the C-terminal aromatic residue for agonist activity and its structure resemblance with AT(1) non-peptide antagonists.

scientific article published in June 2001

Synthesis of new optically active 2-pyrrolidinones

scientific article published on 21 December 2012

Synthesis, binding studies and in vivo biological evaluation of novel non-peptide antihypertensive analogues

scientific article published on 20 March 2006

Synthesis, in silico docking experiments of new 2-pyrrolidinone derivatives and study of their anti-inflammatory activity

scientific article published on 01 April 2011

Synthesis, liposomal formulation and thermal effects on phospholipid bilayers of leuprolide.

scientific article

Synthesis, pH-dependent structural characterization, and solution behavior of aqueous aluminum and gallium citrate complexes.

scientific article

Synthetic Analogues of Aminoadamantane as Influenza Viral Inhibitors-In Vitro, In Silico and QSAR Studies

scientific article published on 01 September 2020

Systematic molecular dynamics, MM-PBSA, and ab initio approaches to the saquinavir resistance mechanism in HIV-1 PR due to 11 double and multiple mutations

scientific article published on 31 July 2014

The application of 3D-QSAR studies for novel cannabinoid ligands substituted at the C1' position of the alkyl side chain on the structural requirements for binding to cannabinoid receptors CB1 and CB2.

scientific article

The application of rational design on phospholipase A(2) inhibitors.

scientific article published on January 2011

The application of solid-state NMR spectroscopy to study candesartan cilexetil (TCV-116) membrane interactions. Comparative study with the AT1R antagonist drug olmesartan

scientific article

The conformation of (-) 8 alpha and (-) 8 beta-hydroxy-delta 9-tetrahydrocannabinols and their interactions with model membranes

scientific article published on 01 January 1988

The conformational properties of the antineoplastic ether lipid 1-thiohexadecyl-2-O-methyl-S-glycero-3-phosphocholine

scientific article published on 01 November 1996

The design and synthesis of a potent Angiotensin II cyclic analogue confirms the ring cluster receptor conformation of the hormone Angiotensin II

scientific article published on 01 January 2000

The discovery of new potent non-peptide Angiotensin II AT1 receptor blockers: a concise synthesis, molecular docking studies and biological evaluation of N-substituted 5-butylimidazole derivatives

scientific article

The modulation of thermal properties of vinblastine by cholesterol in membrane bilayers.

scientific article published in February 2004

The role of the anticancer drug vinorelbine in lipid bilayers using differential scanning calorimetry and molecular modeling.

scientific article published on 29 July 2006

The use of high-resolution solid-state NMR spectroscopy and differential scanning calorimetry to study interactions of anaesthetic steroids with membrane

scientific article published in August 1997

Thermal properties of adamantanol derivatives and their beta-cyclodextrin complexes in phosphatidylcholine bilayers

scientific article published on 01 January 1998

Thermal, dynamic and structural properties of drug AT1 antagonist olmesartan in lipid bilayers

scientific article published on 6 August 2011

Topography and thermotropic properties of cannabinoids in brain sphingomyelin bilayers

scientific article published on 01 January 1996

Topography of alphaxalone and delta 16-alphaxalone in membrane bilayers containing cholesterol

scientific article published in August 1994

Topography of tetrahydrocannabinol in model membranes using neutron diffraction

scientific article published in September 1993

Understanding the Driving Forces That Trigger Mutations in SARS-CoV-2: Mutational Energetics and the Role of Arginine Blockers in COVID-19 Therapy

scientific article published on 11 May 2022

Unveiling the interaction profile of rosmarinic acid and its bioactive substructures with serum albumin

scientific article published on 01 December 2020

pH-specific aqueous synthetic chemistry in the binary cadmium(II)-citrate system. Gaining insight into cadmium(II)-citrate speciation with relevance to cadmium toxicity

scientific article published in June 2005

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