Frontispiece: Structure–Activity Relationships for the Affinity of Chaotropic Polyoxometalate Anions towards Proteins.

Frontispiece: Structure-Activity Relationships for the Affinity of Chaotropic Polyoxometalate Anions towards Proteins Keywords: chaotropic anions; molecular dynamics; polyoxometalates; protein interactions; structure-activity relationships EN chaotropic anions molecular dynamics polyoxometalates protein interactions structure-activity relationships 1 1 1 05/09/20 20200507 NES 200507 B Atomistic molecular dynamics b simulations and QSAR-like modeling techniques were applied to establish relationships between the structure of chaotropic polyoxometalate (POM) anions and their affinity towards biological systems. Chaotropic anions, molecular dynamics, polyoxometalates, protein interactions, structure-activity relationships. [Extracted from the article]