[gmx-users] Diagonalizing matrix (g_covar)

Mark Abraham mark.j.abraham at gmail.com
Sun Feb 17 10:50:54 CET 2013

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


More information about the gromacs.org_gmx-users mailing list