[gmx-users] can the GROMACS transform the amber trajectory to GROMACS trajectory?
David van der Spoel
spoel at xray.bmc.uu.se
Tue May 28 21:17:15 CEST 2002
On Tue, 28 May 2002, bxiong wrote:
>Dear user:
> I think the analysis tools of the GROMACS is very very powerful and convenient, so I
>ask a question:
>can the GROMACS transform the amber trajectory to GROMACS trajectory?
You can read ascii trajectories from Amber straight away. Rename them to
.g87 files and use them. You will need a tpr fiel for most analyses
though.
--
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
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
More information about the gromacs.org_gmx-users
mailing list