ENSEMBLE

ENSEMBLE


Synopsis

Tools to determine and analyze the weighted ensemble of structures in unfolded states

Description

The ENSEMBLE suite contains tools to determine and analyze the weighted ensemble of structures that best represents the unfolded state within the boundaries of a pre-determined conformer pool. In order to do this, a weighted ensemble is used to represent the unfolded state as a collection of rigid structures, each associated with a numerical term proportional to the time-averaged existence of that particular conformation.

URL

http://pound.med.utoronto.ca/~JFKlab/

Versions

NMRbox Version Software Version
3.0.0 2.1,

Keywords

  • Structure Determination
  • Intrinsically Disordered Proteins (IDPs)