[gmx-users] Diagonalizing matrix (g_covar)

[Mark Abraham]

On Fri, Feb 15, 2013 at 11:36 PM, SeokYun123 <kimseokyun3 at gmail.com> wrote:

> Hello!
>
> I'm trying to diagonalize the matrix by using g_covar.
>
> However my matrix is too large (50000x50000) so it won't diagonalize the
> matrix.
>
> Is there a different software or different command that I could try to use
> in order to diagonalize my matrix as quickly as possible?
>

Not with GROMACS. You will need more memory or to review the size of your
problem.

Mark