[gmx-users] User-define non bonded table
Steven Neumann
s.neumann08 at gmail.com
Fri Jun 7 12:08:43 CEST 2013
Dear Gmx Users,
I want to specify a table to mdrun for non bonded parameters. I wish to set
it up for all atoms with same potential. Is there any example of the table
like this? I want use my specific potential so table should have two
columns: X distance [nm] and Y Potential energy {kJ/mol]. Is that right?
How can I tell gromacs to use it for all interactions?
Thanks
Steven
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