The brain contains the highest concentration of cholesterol in the human body, which
emphasizes the importance of cholesterol in brain physiology. Cholesterol is involved in …

The application of classical molecular dynamics (MD) simulations at atomic resolution (fine-
grained level, FG), to most biomolecular processes, remains limited because of the …

Neurodegenerative diseases, such as Alzheimer's, Parkinson's, and Huntington's, affect
millions worldwide and share a common feature: the aggregation of intrinsically disordered …

Neurodegeneration related to Alzheimer's disease has long been linked to the accumulation
of abnormal aggregates of amyloid-β (Aβ) peptides. Pre-fibrillar oligomeric intermediates of …

One of the mechanisms accounting for the toxicity of amyloid peptides in diseases like
Alzheimer's and Parkinson's is the formation of pores on the plasma membrane of neurons …

It is widely recognized that membranes can facilitate the aggregation of amyloid-β (Aβ)
peptides, while Aβ can in turn cause membrane damage. Many studies focus on the peptide …

The self-assembly of amyloid-beta (Aβ) peptides into fibrillar structures in the brain is a
signature of Alzheimer's disease. Recent studies have reported correlations between …

Transmembrane helix folding and self-association play important roles in biological
signaling and transportation pathways across biomembranes. With molecular simulations …

Protein preservation has been a long lasting research topic due to its importance in many
bio-pharmaceutical applications. A” cold chain” is a commonplace solution to protein …

Table S1: Type of coarse-grained beads present in the Aβ fragment K16LVFFAE22, glucose
molecule and the MARTINI polarizable solvent model. Polarized beads are indicated with an …