2012 16:48
Para: Discussion list for GROMACS users
Assunto: Re: [gmx-users] nan in g_anaeig -over
On 27/07/2012 12:31 AM, Joaquim Rui de Castro Rodrigues wrote:
> Dear all,
>
> I am getting a nan while calculating the overlap between covariance matrices
> (in this case, using the same vectors for
On 27/07/2012 12:31 AM, Joaquim Rui de Castro Rodrigues wrote:
Dear all,
I am getting a nan while calculating the overlap between covariance matrices (in this case, using the same vectors for -v and -v2):
g_anaeig455 -v atp/eigenvectors.trr -v2 atp/eigenvectors.trr -over
overlap_atp-atp
I
Dear all,
I am getting a nan while calculating the overlap between covariance matrices
(in this case, using the same vectors for -v and -v2):
g_anaeig455 -v atp/eigenvectors.trr -v2 atp/eigenvectors.trr -over
overlap_atp-atp
I tried different gromacs versions, different -last values, and als
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