[gmx-users] visualization/first solvation shell

David van der Spoel spoel at xray.bmc.uu.se
Wed Feb 18 22:55:01 CET 2004

On Wed, 18 Feb 2004, Osmair Vital de Oliveira wrote:

>I would like on the visualization the first solvation shell  in
>my proteins, is
>possible in gromacs or other program?

trjorder to select the shell, then trjconv to export to pdb.

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David van der Spoel, PhD, Assist. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel

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