[gmx-users] lennard jones 6-12 value setting

라지브간디 rajiv at kaist.ac.kr
Tue Feb 26 10:33:53 CET 2013


Dear gmx,
 
I want set the particular value of lennard jones 6-12 for NO ligand for my simulation. I believe it has be mentioned in topology file created by force field. My questions is how to set these value in topology which created by CHARMM 27 ff?
 
Thanks in advance.


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