[gmx-users] re-weight Metadynamics trajectory from Plumed to make it canonical ensemble

[Tsjerk Wassenaar]

Hey :)


> I think I will just do PCA (g_covar), reweight the covariance matrix and
> obtain modes
>
>
Reweight the covariance matrix? Out of curiosity, how will you do that?

Cheers,

Tsjerk

>
-- 
Tsjerk A. Wassenaar, Ph.D.