Article
Protein dynamic communities from elastic network models align closely to the communities defined by molecular dynamics.
PloS one - 1 Jan 2018
Mishra Sambit Kumar, Jernigan Robert L
Abstract excerpt
Dynamic communities in proteins comprise the cohesive structural units that individually exhibit rigid body motions. These can correspond to structural domains, but are usually smaller parts that move with respect to one another in a protein's internal motions, key to its functional dynamics. Previous studies emphasized their importance to understand the nature of ligand-induced allosteric regulation. These...
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