[gmx-users] filling a mesopore with water

Maryam Kowsar maryam.kowsar at gmail.com
Mon Jun 22 16:37:29 CEST 2015


Dear users,

I want to fill a mesoporous system with water or any other molecules or
atoms. I tested genbox -cp .gro -cs spc216.gro -o but water molecules only
surround the mespore not in the holes. Are there any commands in gromacs?

thank you.


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