Open AccessMolecular dynamics simulation and free energy calculations of the binding characteristics of multi-target anti-Alzheimer natural compounds isolated from <em>Psoralea Fructus</em> to amyloid β-peptide 42
Author(s) -
A E Radwan,
Fars K. Alanazi
Publication year - 2021
Publication title -
proceedings of 7th international electronic conference on medicinal chemistry
Language(s) - English
Resource type - Conference proceedings
DOI - 10.3390/ecmc2021-11374
Subject(s) - molecular dynamics , molecular mechanics , chemistry , biophysics , amyloid beta , biochemistry , binding site , peptide , biology , computational chemistry