[gmx-users] Box of water
Mark.Abraham at anu.edu.au
Tue May 1 04:07:42 CEST 2012
On 1/05/2012 12:02 PM, cuong nguyen wrote:
> Dear Gromacs Users,
> I used the command "genbox -cs spc216.gro -o box1.g96 -p topol.top
> -box 3 3 10" to create box of 3010 water molecules. However, now I
> need to create a same size box with only 846 water molecules. Please
> help me to do this.
Use a suitable combination of editconf, genbox and/or genconf.
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