[gmx-users] Re: DNA simulations
mail2mvskumar at yahoo.com
Wed Jul 4 16:28:59 CEST 2012
Thanks Mark for your response. These are steps I followed to construct
----> editconf -f A.pdb -o A.gro -d 0.3
----> genbox -cp A.gro -cs -nice -20 -o A_water.gro
I have not used any of the topology files (which I believed should be used
in g_select) during the construction and I am not sure of handling it. Also,
I ned to introduce some OH radicals also into the cylinder with some radius
around the DNA. Could you guide me.
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