A review on structural mechanisms of protein-persistent organic pollutant (POP) interactions

N Nagar, H Saxena, A Pathak, A Mishra, KM Poluri - Chemosphere, 2023 - Elsevier
With the advent of the industrial revolution, the accumulation of persistent organic pollutants
(POPs) in the environment has become ubiquitous. POPs are halogen-containing organic …

Characterizing the binding affinity and molecular interplay between quinoline yellow and pepsin

F Hashemi-Shahraki, B Shareghi… - Journal of Molecular …, 2021 - Elsevier
Food dyes, including a broad spectrum of natural and synthetic dyes, are considered
potentially hazardous materials that might pollute the environment and threaten human …

Malachite Green, the hazardous materials that can bind to Apo-transferrin and change the iron transfer

S Farhadian, F Hashemi-Shahraki, S Asadpour… - International Journal of …, 2022 - Elsevier
Different groups of synthetic dyes might lead to environmental pollution. The binding affinity
among hazardous materials with biomolecules necessitates a detailed understanding of …

Investigation on the interaction of aromatic organophosphate flame retardants with human serum albumin via computer simulations, multispectroscopic techniques …

X Ma, L Kuang, X Wang, Z Zhang, C Chen… - International Journal of …, 2023 - Elsevier
Organophosphate flame retardants (OPFRs) are newly emerging estrogenic environmental
pollutants, which attracted widespread public interest owing to their potential threats to …

Investigation of the interaction behavior between quercetin and pepsin by spectroscopy and MD simulation methods

F Hashemi-Shahraki, B Shareghi… - International Journal of …, 2023 - Elsevier
The ability of a therapeutic compound to bind to proteins is critical for characterizing its
therapeutic impacts. We have selected quercetin (Qu), a most common flavonoid found in …

Evaluation of interactions between food colorant, tartrazine, and Apo-transferrin using spectroscopic analysis and docking simulation

H Jafari-Arvari, SS Saei-Dehkordi… - Journal of Molecular …, 2021 - Elsevier
Colors are one of the most widely used additives in the food industry. Despite the fact that
tartrazine, which is an artificial synthetic acid azo dye, has frequently been used worldwide …

[HTML][HTML] Molecular simulation-based insights into dye pollutant adsorption: A perspective review

I Salahshoori, Q Wang, MAL Nobre… - Advances in Colloid and …, 2024 - Elsevier
Growing concerns about environmental pollution have highlighted the need for efficient and
sustainable methods to remove dye contamination from various ecosystems. In this context …

A comprehensive insight into the effects of punicalagin on pepsin: Multispectroscopy and simulations methods

Y Yue, Y Wang, Q Tu, Y Xu, Y Zhang, Q Tang… - Journal of Molecular …, 2022 - Elsevier
Punicalagin has been attracted much attention owing to its biological activity of regulating
blood glucose and potential as a health benefits. Herein, the binding behavior of …

Noncovalent interactions between Quinoline yellow and trypsin: In vitro and in silico methods

E Yadollahi, B Shareghi, S Farhadian - Journal of Molecular Liquids, 2022 - Elsevier
These days, synthetic colors are extensively used in many products, so it is essential to get
more information about their side effects. We selected Quinoline yellow as an edible color …

Effect of Naphthol yellow S as a food dye on the lysozyme structure and its mechanisms of action

Z Asemi-Esfahani, B Shareghi, S Farhadian… - Journal of Molecular …, 2021 - Elsevier
It is necessary to investigate enzymes structural changes in the food industry. In the recent
years, the reaction of small-scale molecules with enzymes has been widely addressed. In …