Results 31 to 40 of about 10,471,624 (302)
, 2022 S.198-204 : Abb.,Tab.Quantitative Structure-Activity Relationships (QSARs) are derived to predict oral toxicity data of aliphatic amines and anilines for rats.
Klein, W., Jäckel, H.
core +1 more source
Characterization of Phenolic Acid Antimicrobial and Antioxidant Structure–Property Relationships
Pharmaceutics, 2020 Plant-derived phenolic acids (PAs) are small molecules with antimicrobial, antioxidant, anti-inflammatory, and pro-coagulant properties. Their chemistry enables facile potential incorporation into biomaterial scaffolds to provide naturally-derived ...
Jingyi Liu +3 more
doaj +1 more source
, 2021 Dye-sensitized photocatalytic (DSP) approach is considered as one of the promising approaches for developing visible light- and near-infrared light-responsive photocatalysts.
Sundaram Bhardwaj Ramakrishnan (9017405) +5 more
core +1 more source
Revealing Structure-Property Relationships in Polybenzenoid Hydrocarbons with Interpretable Machine-Learning [PDF]
, 2022 The structure-property relationships of polybenzenoid hydrocarbons (PBHs) were investigated with interpretable machine learning, for which two new tools were developed and applied.
Zeev, Gross +4 more
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Insight into the structure-property relationships of intramolecularly-catalyzed epoxy vitrimers
Materials & Design, 2022 Vitrimers are emerging dynamic polymers with exchangeable associated networks that can potentially be used as substitutes for conventional thermosetting polymers, whose healing and recycling are difficult.
Huanbo Wang +5 more
doaj +1 more source
Nanostructured Metal Oxides in Supercapacitors: Structure–Property–Performance Relationships [PDF]
EPJ Web of ConferencesMetal oxide transition materials that exhibit pseudo-capacitive performance have been extensively studied due to their ability to be easily modified with respect to both structure and redox activity.
Anegondi Anish Krishna +5 more
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Towards structure–property–function relationships for eumelanin [PDF]
Soft Matter, 2006 We discuss recent progress towards the establishment of important structure-property-function relationships in eumelanins - key functional bio-macromolecular systems responsible for photo-protection and immune response in humans, and implicated in the development of melanoma skin cancer.
Meredith, P. +5 more
openaire +7 more sources
FEBS Letters, EarlyView.Structural and biochemical characterisations show that the planar cell polarity (PCP) protein Inturned harbours a unique PDZ‐like domain that does not bind canonical PDZ‐binding motifs (PBMs) like that of another PCP protein Vangl2. In contrast, the apical‐basal polarity protein Scribble contains four PDZ domains that bind Vangl2, but one PDZ domain ...
Stephan Wilmes +4 more
wiley +1 more source
Structure–Property Relationships in Transition Metal Dichalcogenide Bilayers under Biaxial Strains
Nanomaterials, 2021 This paper reports a Density Functional Theory (DFT) investigation of the electron density and optoelectronic properties of two-dimensional (2D) MX2 (M = Mo, W and X = S, Se, Te) subjected to biaxial strains.
Pingping Jiang +2 more
doaj +1 more source
Structural insights into an engineered feruloyl esterase with improved MHET degrading properties
FEBS Letters, EarlyView.A feruloyl esterase was engineered to mimic key features of MHETase, enhancing the degradation of PET oligomers. Structural and computational analysis reveal how a point mutation stabilizes the active site and reshapes the binding cleft, expading substrate scope.
Panagiota Karampa +5 more
wiley +1 more source