[gmx-users] Convergence of system

SHYANTANI MAITI shyantani.maiti at gmail.com
Sun Jul 15 08:02:26 CEST 2018

Dear all,
How to understand whether a system converges from the time correlation
function of the vectors formed by Cα? I have constructed the correlation
function from the eigen vector values of the frames of the trajectory.
After this I have applied the g_analyze function to the xvg file created
from covar function of gromacs. How can I understand the convergence of
system from the correlation function?
Best regards,
*Shyantani Maiti*

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