10.1371/journal.pone.0043253.g003
Jonathan C. Fuller
Jonathan
C. Fuller
Richard M. Jackson
Richard M.
Jackson
Thomas A. Edwards
Thomas
A. Edwards
Andrew J. Wilson
Andrew J.
Wilson
Michael R. Shirts
Michael R.
Shirts
Mean Autodock binding energy score and corresponding cluster occupancy with a 2 Å RMSD cutoff.
Public Library of Science
2012
autodock
binding
corresponding
occupancy
rmsd
2012-08-20 02:36:04
Figure
https://plos.figshare.com/articles/figure/_Mean_Autodock_binding_energy_score_and_corresponding_cluster_occupancy_with_a_2_197_RMSD_cutoff_/259364
<p>Representative conformations used as initial conformations for MD simulations and the cluster from which they originated are highlighted. Highly populated clusters with low mutual RMSD all exist within 2.5 kcal/mol, meaning that the docking scoring function is unable to determine a consensus bound conformation.</p>