[gmx-users] Interpretation of RMSD matrix
Mark Abraham
mark.j.abraham at gmail.com
Fri Jun 2 18:19:54 CEST 2017
Hi,
I suggest you decide what you want to observe before choosing a tool to
observe with :-) A telescope is no good for micro-organisms.
Mark
On Fri, 2 Jun 2017 17:20 Apramita Chand <apramita.chand at gmail.com> wrote:
> Dear All,
> I would be grateful if you could help me with links to relevant
> papers/websites/sources on how to interpret RMSD matrices when comparing
> all frames of single trajectory to reference structure and also when
> comparing two different trajectories.
>
> I am taking the reference structure from the input .tpr file. What in your
> opinion, is a better option to compare when taking RMSD? The starting
> structure .gro file or the .tpr file(after equilibration) ?
>
>
> Yours sincerely
> Apramita
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