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Rational Design of Cost-Effective 4-Styrylcoumarin Fluorescent Derivatives for Biomolecule Labeling

Molecules (Basel, Switzerland), 2023-09, Vol.28 (19), p.6822

2023

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New Red-Shifted 4-Styrylcoumarin Derivatives as Potential Fluorescent Labels for Biomolecules

Molecules (Basel, Switzerland), 2022-02, Vol.27 (5), p.1461

2022

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Interactions between Rhodamine Dyes and Model Membrane Systems-Insights from Molecular Dynamics Simulations

Molecules (Basel, Switzerland), 2022-02, Vol.27 (4), p.1420

2022

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Interaction of Hoechst 33342 with POPC Membranes at Different pH Values

Molecules (Basel, Switzerland), 2023-07, Vol.28 (15), p.5640

2023

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Modeling Gd3+ Complexes for Molecular Dynamics Simulations: Toward a Rational Optimization of MRI Contrast Agents

Inorganic chemistry, 2022-08, Vol.61 (30), p.11837-11858

2022

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Acetonitrile Adducts of Tranexamic Acid as Sensitive Ions for Quantification at Residue Levels in Human Plasma by UHPLC-MS/MS

Pharmaceuticals (Basel, Switzerland), 2021-11, Vol.14 (12), p.1205

2021

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A chiral electrochemical system based on l-cysteine modified gold nanoparticles for propranolol enantiodiscrimination: Electroanalysis and computational modelling

Electrochimica acta, 2019-12, Vol.326, p.134961, Article 134961

2019

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Methyl-cyclopentadienyl Ruthenium Compounds with 2,2′-Bipyridine Derivatives Display Strong Anticancer Activity and Multidrug Resistance Potential

Inorganic chemistry, 2018-04, Vol.57 (8), p.4629-4639

2018

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Influence of Ionic Liquids on the Aggregation and Preaggregation Phenomena of Asphaltenes in Model Solvent Mixtures by Molecular Dynamics Simulations and Quantum Mechanical Calculations: The Effect of Cation’s Shape and Size

Energy & fuels, 2024-03, Vol.38 (5), p.3693-3712

2024

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Unrecognized Emergence of Chikungunya Virus during a Zika Virus Outbreak in Salvador, Brazil

PLoS neglected tropical diseases, 2017-01, Vol.11 (1), p.e0005334

2017

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Accounting for van der Waals interactions between adsorbates and surfaces in density functional theory based calculations: selected examples

RSC advances, 2013-01, Vol.3 (32), p.13085

2013

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Fatigue crack growth versus plastic CTOD in the 304L stainless steel

Engineering fracture mechanics, 2019-06, Vol.214, p.487-503

2019

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Chiral enhancement via surface-confined supramolecular self-assembly at the electrified liquid/solid interface

Electrochimica acta, 2021-08, Vol.387, p.138464, Article 138464

2021

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Influence of Ionic Liquids on the Aggregation and Pre-aggregation Phenomena of Asphaltenes in Model Solvent Mixtures by Molecular Dynamics Simulations and Quantum Mechanical Calculations

Energy & fuels, 2022-08, Vol.36 (16), p.9048-9065

2022

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Fluorescence of nitrobenzoxadiazole (NBD)-labeled lipids in model membranes is connected not to lipid mobility but to probe location

Physical chemistry chemical physics : PCCP, 2016-03, Vol.18 (10), p.7042-7054

2016

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Fatigue crack growth modelling based on CTOD for the 7050‐T6 alloy

Fatigue & fracture of engineering materials & structures, 2017-08, Vol.40 (8), p.1309-1320

2017

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Flow-based bioconjugation of coumarin phosphatidylethanolamine probes: Optimised synthesis and membrane molecular dynamics studies

Biochimica et biophysica acta. Biomembranes, 2024-10, Vol.1866 (7), p.184335, Article 184335

2024

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Fatigue crack growth in the 2050-T8 aluminium alloy

International journal of fatigue, 2018-10, Vol.115, p.79-88

2018

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Design and development of molecularly imprinted polymers for the selective extraction of deltamethrin in olive oil: An integrated computational-assisted approach

Journal of Chromatography, 2015-08, Vol.1409 (C), p.1-10

2015

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Adsorption of CO on the rutile TiO2(110) surface: a dispersion-corrected density functional theory study

Physical chemistry chemical physics : PCCP, 2017, Vol.19 (3), p.2487-2494

2017

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A magnetic controllable tool for the selective enrichment of dimethoate from olive oil samples: A responsive molecular imprinting-based approach

Food chemistry, 2018-07, Vol.254 (C), p.309-316

2018

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Recent developments in molecular dynamics simulations of fluorescent membrane probes

Molecules, 2011-06, Vol.16 (7), p.5437-5452

2011

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NBD-Labeled Cholesterol Analogues in Phospholipid Bilayers: Insights from Molecular Dynamics

The journal of physical chemistry. B, 2013-11, Vol.117 (44), p.13731-13742

2013

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A photoswitchable “host-guest” approach for the selective enrichment of dimethoate from olive oil

Analytica chimica acta, 2018-12, Vol.1035, p.60-69

2018

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DFT Investigations on the Ring-Opening Polymerization of Trimethylene Carbonate Catalysed by Heterocyclic Nitrogen Bases

Catalysts, 2022-10, Vol.12 (10), p.1280

2022

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Rational Design of Cost-Effective 4-Styrylcoumarin Fluorescent Derivatives for Biomolecule Labeling

New Red-Shifted 4-Styrylcoumarin Derivatives as Potential Fluorescent Labels for Biomolecules

Interactions between Rhodamine Dyes and Model Membrane Systems-Insights from Molecular Dynamics Simulations

Interaction of Hoechst 33342 with POPC Membranes at Different pH Values

Modeling Gd3+ Complexes for Molecular Dynamics Simulations: Toward a Rational Optimization of MRI Contrast Agents

Acetonitrile Adducts of Tranexamic Acid as Sensitive Ions for Quantification at Residue Levels in Human Plasma by UHPLC-MS/MS

A chiral electrochemical system based on l-cysteine modified gold nanoparticles for propranolol enantiodiscrimination: Electroanalysis and computational modelling

Methyl-cyclopentadienyl Ruthenium Compounds with 2,2′-Bipyridine Derivatives Display Strong Anticancer Activity and Multidrug Resistance Potential

Influence of Ionic Liquids on the Aggregation and Preaggregation Phenomena of Asphaltenes in Model Solvent Mixtures by Molecular Dynamics Simulations and Quantum Mechanical Calculations: The Effect of Cation’s Shape and Size

Unrecognized Emergence of Chikungunya Virus during a Zika Virus Outbreak in Salvador, Brazil

Accounting for van der Waals interactions between adsorbates and surfaces in density functional theory based calculations: selected examples

Fatigue crack growth versus plastic CTOD in the 304L stainless steel

Chiral enhancement via surface-confined supramolecular self-assembly at the electrified liquid/solid interface

Influence of Ionic Liquids on the Aggregation and Pre-aggregation Phenomena of Asphaltenes in Model Solvent Mixtures by Molecular Dynamics Simulations and Quantum Mechanical Calculations

Fluorescence of nitrobenzoxadiazole (NBD)-labeled lipids in model membranes is connected not to lipid mobility but to probe location

Fatigue crack growth modelling based on CTOD for the 7050‐T6 alloy

Flow-based bioconjugation of coumarin phosphatidylethanolamine probes: Optimised synthesis and membrane molecular dynamics studies

Fatigue crack growth in the 2050-T8 aluminium alloy

Design and development of molecularly imprinted polymers for the selective extraction of deltamethrin in olive oil: An integrated computational-assisted approach

Adsorption of CO on the rutile TiO2(110) surface: a dispersion-corrected density functional theory study

A magnetic controllable tool for the selective enrichment of dimethoate from olive oil samples: A responsive molecular imprinting-based approach

Recent developments in molecular dynamics simulations of fluorescent membrane probes

NBD-Labeled Cholesterol Analogues in Phospholipid Bilayers: Insights from Molecular Dynamics

A photoswitchable “host-guest” approach for the selective enrichment of dimethoate from olive oil

DFT Investigations on the Ring-Opening Polymerization of Trimethylene Carbonate Catalysed by Heterocyclic Nitrogen Bases

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