Application of sodium sulfobutylether-β-cyclodextrin based on encapsulation

J Huang, X Wang, T Huang, Y Yang, J Tu, J Zou… - Carbohydrate …, 2024 - Elsevier
Sodium Sulfobutylether-β-cyclodextrin (SBE-β-CD) is a derivative of β-cyclodextrin,
characterized by its stereo structure, which closely resembles a truncated cone with a …

[HTML][HTML] Current status of quantum chemical studies of cyclodextrin host–guest complexes

AH Mazurek, Ł Szeleszczuk - Molecules, 2022 - mdpi.com
This article aims to review the application of various quantum chemical methods (semi-
empirical, density functional theory (DFT), second order Møller–Plesset perturbation theory …

Modifying enzymatic substrate binding within a metal–organic capsule for supramolecular catalysis

Y Yang, X **g, Y Shi, Y Wu… - Journal of the American …, 2023 - ACS Publications
Supramolecular catalysis is established to modify reaction kinetics by substrate
encapsulation, but manipulating the thermodynamics of electron-transfer reactions remains …

Computational investigation of dimethoate and β-cyclodextrin inclusion complex: molecular structures, intermolecular interactions, and electronic analysis

A Benaissa, A Bouhadiba, N Naili, F Chekkal… - Structural Chemistry, 2023 - Springer
The proposed study concerns the inclusion complexation of dimethoate (DMT) in the β-
cyclodextrin (β-CD) molecule cage using a 1: 1 stoichiometry. The interactions between …

One-Dimensional Responsive Photonic Crystals Assembled by Polymer Nanogels and TiO2 Nanoparticles for Rapid Detection of Glucose

T Shi, D Kou, L Gao, Y Xue, S Zhang… - ACS Applied Nano …, 2024 - ACS Publications
Diabetes, characterized by chronic hyperglycemia, has become a major threat to human
health. A noninvasive, continuous, and rapid visual detection of glucose is still a challenge …

A dispersion corrected DFT investigation of the inclusion complexation of dexamethasone with β-cyclodextrin and molecular docking study of its potential activity …

Y Belhocine, S Rahali, H Allal, IM Assaba… - Molecules, 2021 - mdpi.com
The encapsulation mode of dexamethasone (Dex) into the cavity of β-cyclodextrin (β-CD), as
well as its potential as an inhibitor of the COVID-19 main protease, were investigated using …

Computational insights on the adsorption of glycine, methionine, tyrosine and phenylalanine on the zinc oxide nanocluster Zn12O12

S Rahali, M Damous, Y Belhocine, N Sbei… - Theoretical Chemistry …, 2024 - Springer
The current work investigated the interaction of ZnO nanoparticles (NPs) with glycine,
tyrosine, methionine and phenylalanine.(ZnO) 12 cage-like cluster was modeled using the …

Unraveling boric acid interactions with macrocyclic hosts: DFT insights into the key role of hydrogen bonding in complex stabilization

N Mekarba, F Krid, Y Belhocine, A Bouhadiba… - Theoretical Chemistry …, 2025 - Springer
A density functional theory (DFT) investigation was performed to elucidate the interaction
mechanisms between boric acid (BA) and various macrocyclic host molecules. The …

Synthesis, characterization, and charge transfer interaction of a dibromopyromelliticdiimide based [2+ 2] macrocycle with p-xylene molecule: a combined experimental …

ME Halim, U Shaha, T Shinmyozu, MA Ali - Journal of Molecular Structure, 2025 - Elsevier
The pyromellitic diimide-based tetrabromo [2+ 2] macrocycle 3 has been synthesized,
characterized, and their charge transfer interaction with the p-xylene molecule was studied …

Three-in-one: exploration of co-encapsulation of cabazitaxel, bicalutamide and chlorin e6 in new mixed cyclodextrin-crosslinked polymers

E Pancani, D Veclani, M Agnes, A Mazza, A Venturini… - RSC …, 2023 - pubs.rsc.org
We explored a series of cyclodextrin (CyD) polymers composed either of a single CyD type
or a mixture of two CyD types to encapsulate simultaneously different compounds with …