[gmx-users] tip3p water in gromacs_4.5.4

Tomek Wlodarski tomek.wlodarski at gmail.com
Fri Dec 16 12:34:41 CET 2011


Hi Shahid,

Use spc216.gro file, it also works for tip3p water model.
Best!

tomek

On Fri, Dec 16, 2011 at 11:26 AM, shahid nayeem <msnayeem at gmail.com> wrote:
> Dear all
> I want to use tip3p water model for solvating my protein with genbox command
> . I couldnt find tip3p.gro file in Gromacs/share/top folder . please help me
> I am following using command
> genbox -cp protein_box.gro -cs tip3p.gro -o solv.gro -p *.top
> It says tip3p.gro not found.
> Please help.
> shahid Nayeem
>
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