Figure 3.
The overall average RMSD and Shape-Tanimoto (ST) values of the conformer models for all 25,972 structures as a function of the model building energy window and the torsion search energy window (in kcal/mol).
Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.