Non-covalent interaction, adsorption characteristics and solvent effect of procainamide anti-arrhythmias drug on silver and gold loaded silica surfaces: SERS spectroscopy, density functional theory and molecular docking investigations. [PDF]
RSC Adv, 2023 Vetrivelan V +3 more
europepmc +1 more source
Covalent-Frameworked 2D Crown Ether with Chemical Multifunctionality
Here, we present the synthesis and characterization of a novel 2D crystalline framework, named C2O, which mainly consists of carbon and oxygen in a 2:1 molar ratio and features crown ether holes in its skeletal structure.
Namjun Park (17931169) +10 more
core +1 more source
Intracrystalline Void‐Mediated Toughening of Brittle Crystals in Quail Eggshells
Advanced Functional Materials, EarlyView.In quail eggshells, the high density and disordered arrangement of intracrystalline voids inhibit lattice cleavage, suppress long‐range crack propagation, and promote deformation twinning and quasi‐plasticity, serving as an essential toughening motif. We show that these voids remain within a narrow subcritical size range and therefore predominantly do ...
Jingxiao Zhong +16 more
wiley +1 more source
Thermodynamic and Computational (DFT) Study of Non-Covalent Interaction Mechanisms of Charge Transfer Complex of Linagliptin with 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone (DDQ) and Chloranilic acid (CHA). [PDF]
Molecules, 2022 Bakheit AH, Al-Salahi R, Al-Majed AA.
europepmc +1 more source
Theoretical Study of Non-covalent Interaction from small molecules to Biomolecules
, 2015 xv Abstract The aim of this thesis is to investigate the accurate stabilization energy and binding free energy in various non-covalent complexes spanned from small organic molecules to biomolecules.
Haldar, Susanta
core
Unexpected Asymmetric Mn‐Sb Site Mixing and Reentrant Spin‐Glass State of MnSb2Te4
Advanced Functional Materials, EarlyView.MnSb2Te4 is an intrinsic magnetic topological insulator. Its properties are extraordinarily sensitive to tiny defects, making structural studies essential for understanding how magnetism and topology work together. This work shows that Mn can be unevenly distributed within the crystal and how that disorder is linked to a newly reported spin‐glass state
Gustavo Chavez Ponce de Leon +7 more
wiley +1 more source
Advanced ScienceThe interactions between ionic charge carriers and host framework critically govern electrochemical reactions and ion‐storing performance, serving as a pivotal design consideration for energy storage devices. However, the fundamental understanding of the
Tiantian She +7 more
doaj +1 more source
Advanced Functional Materials, EarlyView.An amphiphilic GOx nanoamphizyme was constructed by covalently introducing hydrophobic PPNI linkers onto GOx, enabling spontaneous self‐assembly into tunable nanoparticles. Mild crosslinking further stabilized the assemblies and enhanced catalytic performance and stability.
Yuan‐Hao Hsiao +4 more
wiley +1 more source
Improvement of protein emulsion stability through glycosylated black bean protein covalent interaction with (-)-epigallocatechin-3-gallate. [PDF]
RSC Adv, 2021 Wang J +6 more
europepmc +1 more source
GeS as an Emerging OTS Material: Atomic Structure and Modeling of ON/OFF Switching
Advanced Functional Materials, EarlyView.The structural puzzle of glassy GeS, an advanced memory‐selector material, has finally been disentangled, revealing a patchwork of mixed tetrahedral and trigonal species. Under a high electric field, over‐ and under‐coordinated Ge and S defects, together with three‐membered rings, form an interconnected network associated with localized and extended ...
Andrey Tverjanovich +13 more
wiley +1 more source