[gmx-users] question about genbox
mdsimulation at hotmail.com
Tue Nov 1 20:44:09 CET 2005
I'm trying to solvate 200 molecules of Glycine in water and I need a
certaine concentration in the box. How can I determine the number of water
molecules to be added to the glycine. when I run the genbox command it gives
me 1712 water molecule and I need them to be 2650 instead.
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