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Foodinformatics: Quantitative Structure-Property Relationship Modeling of Volatile Organic Compounds in Peppers
The aim of this work was the foodinformatic (chemoinformatic) modeling of volatile organic...
Fluorescence detection and removal of copper from water using a biobased and biodegradable 2D soft material
We have developed a green and robust fluorogenic (λex = 410 nm, λem = 510 nm) cellulose membrane...
The Tetrazole Analogue of the Auxin Indole-3-acetic Acid Binds Preferentially to TIR1 and Not AFB5
Indole-3-acetic acid (auxin) is considered one of the cardinal hormones in plant growth and...
Discovery of potent and selective inhibitors of the Escherichia coli M1- aminopeptidase via multicomponent solid-phase synthesis of tetrazole-peptidomimetics
The Escherichia coli neutral M1-aminopeptidase (ePepN) is a novel target identified for the...
Bar adsorptive microextraction (BAE) coated with mixed sorbent phases
The present work proposes the application of bar adsorptive microextraction coated with mixed...
Internal Concentrations in Gammarids Reveal Increased Risk of Organic Micropollutants in Wastewater-Impacted Streams
Internal concentrations link external exposure to the potential effect, as they reflect what the...
Structural Characterization of Agonist Binding to Protease- Activated Receptor 2 through Mutagenesis and Computational Modeling
Protease-activated receptor 2 (PAR2) is a G-protein-coupled receptor that is activated by...
Conjugates of methylene blue with y-carboline derivatives as new multifunctional agents for the treatment of neurodegenerative diseases
We studied the inhibitory activity of methylene blue (MB) γ-carbolines (gC) conjugates (MB-gCs)...
Inhibition of Human Drug Transporter Activities by the Pyrethroid Pesticides Allethrin and Tetramethrin
Pyrethroids are widely-used chemical insecticides, to which humans are commonly exposed, and known...
Machine learning for the prediction of molecular dipole moments obtained by density functional theory
Machine learning (ML) algorithms were explored for the fast estimation of molecular dipole moments...
Human Recombinant VEGFR2D4 Biochemical Characterization to Investigate Novel Anti VEGFR2D4 Antibodies for Allosteric Targeting of VEGFR2
VEGF-A/VEGFR2 complex is the major signaling pathway involved in angiogenesis and the inhibition of...
Data Visualization, Regression, Applicability Domains and Inverse Analysis Based on Generative Topographic Mapping
This paper introduces two generative topographic mapping (GTM) methods that can be used for data...