[gmx-users] How to get the protein with bound water molecules.
rahulbanjee at yahoo.co.in
Wed Jun 4 16:17:01 CEST 2003
Dear Gromacs users,
I am simulating a modelled protein with SPC water. After simulation I want to get the protein with only bound water . From a large number of water molecule it is very difficult to find out only the bound water. Can anybody please help me? Thanking you in anticipation,
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