Multi-FindCore Toolbox

Extends FindCore Toolbox to cluster a set of structural models and superimpose each cluster
244 Downloads
Updated 17 Jun 2011

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This toolbox extends the FindCore toolbox by first clustering the input set of structural models (create_multiensemble) and then superimposing each cluster separately. This allows for appropriate assessment of the uncertainty or flexibility in protein structure when more than one inherent conformation is present. A routine for Boltzmann sampling is also included. This toolbox is of potential utility in analyzing simulated annealing results and trajectories obtained from other enhanced sampling approaches.

Cite As

David Snyder (2024). Multi-FindCore Toolbox (https://www.mathworks.com/matlabcentral/fileexchange/31842-multi-findcore-toolbox), MATLAB Central File Exchange. Retrieved .

MATLAB Release Compatibility
Created with R2008b
Compatible with any release
Platform Compatibility
Windows macOS Linux
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Version Published Release Notes
1.0.0.0