[gmx-users] (no subject)
Nguyen Hoang Phuong
phuong at theochem.uni-frankfurt.de
Fri Feb 22 10:49:13 CET 2002
Dear Dr. David van der Spoel,
g_chi program can only give me the distribution of phi (or psi). I would
like to see phi=phi(t) (or psi=psi(t)).
Phuong
------
> On Thu, 21 Feb 2002, Nguyen Hoang Phuong wrote:
>
> >I am a new Gromacs user. I have simulated the small peptide in H2O. I would like to see
> >the functions phi=phi(t) or psi=psi(t). I am not very
> >family with the output files and it will take time to extract
> >data. Therefore any help to plot this function is appreciated.
>
> Check out the g_chi program. It does all that you want.
>
> Groeten, David.
> ________________________________________________________________________
> Dr. David van der Spoel, Biomedical center, Dept. of Biochemistry
> Husargatan 3, Box 576, 75123 Uppsala, Sweden
> phone: 46 18 471 4205 fax: 46 18 511 755
> spoel at xray.bmc.uu.se spoel at gromacs.org http://zorn.bmc.uu.se/~spoel
> ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
>
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