Discovery of Natural Cholinesterase Inhibitors via Integrated Computational Studies using Labdane-Related Diterpenoids-based Pharmacophore Model and in-vitro studies

This study integrates computational pharmacophore modeling, molecular dynamics, and in-vitro experiments to identify Glabridin as a promising dual cholinesterase inhibitor for Alzheimer's disease treatment, validating a rational strategy for discovering multifunctional natural product leads.

Original authors: Rinku Rautela, Shraddha M Gupta, Anand Gaurav