Molecular Dynamic simulations of Aβ42 dimers with solid-state NMR restraints capture the key structural motifs in Aβ42 fibrillation pathways
Angelo L. Chu, Betty Suping Lu Chu, Wei Qiang
This study uses molecular dynamics simulations with solid-state NMR restraints to analyze Aβ42 dimer structural changes during fibrillation, revealing key motifs and pathway differences with and without membrane interactions.
ACS Omega · Jul 15, 2026Peer-reviewedBiophysics