Mechanistic insights into the mitigation of Aβ aggregation and protofibril destabilization by ad-enantiomeric decapeptide rk10
According to clinical studies, the development of Alzheimer's disease (AD) is linked to the
abnormal aggregation of amyloid-β (Aβ) peptides into toxic soluble oligomers, protofibrils as …
abnormal aggregation of amyloid-β (Aβ) peptides into toxic soluble oligomers, protofibrils as …
Inhibitory effect of saffron components on hIAPP fibrils formation; a molecular dynamics simulation study
A Kordzadeh, M Minaeian, AR SA - Computational and Theoretical …, 2024 - Elsevier
Molecular dynamics simulations were used to investigate how saffron components inhibited
the formation of human islet amyloid polypeptide's fibrils (hIAPP). hIAPP in a water medium …
the formation of human islet amyloid polypeptide's fibrils (hIAPP). hIAPP in a water medium …
Concentration-dependent mechanism of the binding behavior of ibuprofen to the cell membrane: A molecular dynamic simulation study
Ibuprofen is a commonly used drug for treating headaches, pain, and fever. The lipid bilayer
is the primary and most important interface for drugs to interact with biological systems …
is the primary and most important interface for drugs to interact with biological systems …
Fucosterol from Sargassum horridum as an amyloid-beta (Aβ1-42) aggregation inhibitor: in vitro and in silico studies
ES Castro-Silva, M Bello… - Journal of …, 2021 - Taylor & Francis
The number of patients diagnosed with Alzheimer's disease (AD) increases each year, and
there are currently few treatment strategies to decrease the symptoms of AD; furthermore …
there are currently few treatment strategies to decrease the symptoms of AD; furthermore …
Design of gallic acid–glutamine conjugate and chemical implications for its potency against Alzheimer's amyloid-β fibrillogenesis
S Xu, Y Sun, X Dong - Bioconjugate Chemistry, 2022 - ACS Publications
Epigallocatechin-3-gallate (EGCG) has been widely recognized as a potent inhibitor of
Alzheimer's amyloid-β (Aβ) fibrillogenesis. We found that gallic acid (GA) has superior …
Alzheimer's amyloid-β (Aβ) fibrillogenesis. We found that gallic acid (GA) has superior …
Probing the fibrillation of lysozyme by nanoscale-infrared spectroscopy
Amyloid fibrillation is the root cause of several neuro as well as non-neurological disorders.
Understanding the molecular basis of amyloid aggregate formation is crucial for deciphering …
Understanding the molecular basis of amyloid aggregate formation is crucial for deciphering …
Structural and molecular insights into tacrine-benzofuran hybrid induced inhibition of amyloid-β peptide aggregation and BACE1 activity
Amyloid-β (Aβ) aggregation and β-amyloid precursor protein cleaving enzyme 1 (BACE1)
are the potential therapeutic drug targets for Alzheimer's disease (AD). A recent study …
are the potential therapeutic drug targets for Alzheimer's disease (AD). A recent study …
A computational study of the R120G mutation in human αB-crystallin: implications for structural stability and functionality
M Darvazi, M Ghorbani, S Ramazi… - Journal of …, 2024 - Taylor & Francis
The eye is a vital organ in the visual system, which is composed of transparent vascular
tissue. αB-crystallin, a significant protein found in the lens, plays a crucial role in our …
tissue. αB-crystallin, a significant protein found in the lens, plays a crucial role in our …
Insight into the effect of ibuprofen on the permeability of the membrane: a molecular dynamic simulation study
M Ghorbani, G Dehghan… - Journal of Biomolecular …, 2025 - Taylor & Francis
Studying interactions between drugs and cell membranes is of great interest to designing
novel drugs, optimizing drug delivery, and discerning drug mechanism action. In this study …
novel drugs, optimizing drug delivery, and discerning drug mechanism action. In this study …
Inhibition of amyloid-β (16–22) aggregation by polyphenols using replica permutation with solute tempering molecular dynamics simulation
Aggregates of amyloid-β (Aβ) peptides are thought to cause Alzheimer's disease.
Polyphenolic compounds are known to inhibit Aβ aggregation. We applied replica …
Polyphenolic compounds are known to inhibit Aβ aggregation. We applied replica …