Acetylcholinesterase (AChE) is characterized as a key target for designing inhibitors to
prevent Alzheimer's disease (AD). The binding free energy of a ligand to the AChE enzyme …

The aggregation of amyloid beta (Aβ) peptides is associated with the development of
Alzheimer's disease (AD). However, there has been a growing belief that the oligomerization …

Advances in Alzheimer's disease (AD) are related to the oligomerization of Amyloid β (Aβ)
peptides. Therefore, alteration of the process can prevent AD. We investigated the Aβ42 …

We investigate the prevalence, and so the role in the amyloidogenesis, of biased
conformations in large ensembles of monomeric forms for Aβ42 and Aβ40 that can trigger …

Oligomerization of amyloid beta (Aβ) peptides has been considered as the crucially
causative agent in the development of Alzheimer's disease. Etersalate, a nonsteroidal anti …

A comprehensive understanding of the aggregation mechanism in amyloid beta 42 (Aβ42)
peptide is imperative for developing therapeutic drugs to prevent or treat Alzheimer's …

The azido asymmetric stretching motion is widely used for the elucidation of the intrinsic
conformational preference and folding mechanism of protein since it has strong vibrational …

We theoretically and experimentally analyzed a conformational ensemble of a small,
characteristic polypeptide consisting of positively-and negatively-charged amino acid …

There are many events in nature, like self-assembly of peptides, which span a wide range of
time and space. While some multiscale phenomena have detrimental effects and play a …