Optimising Elastic Network Models for Protein Dynamics and Allostery: Spatial and Modal Cut-offs and Backbone Stiffness
I. Dubanevics, T. C. B. McLeish
This study optimizes Elastic Network Models (ENMs) for protein dynamics by evaluating the effects of distance cut-offs, mode cut-offs, and backbone stiffness on three proteins.
bioRxiv · May 13, 2022Biophysics