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.
MD simulation trajectory analysis. (A) RMSD change of LIG_Heavy atoms in MD simulation. (B) RMSD change of S-protein backbone atoms in MD simulation. (C) Change of backbone RMSD of complex system relative to crystal structure position with simulation time. (D) RMSF of residues in the protein during dynamics simulations.
