[gmx-users] soft core potential

Ilya Chorny ichorny at maxwell.compbio.ucsf.edu
Mon Oct 6 21:15:04 CEST 2003


Hi I was wondering if anybody has an answer to my question?

Ilya

On Thu, 2003-10-02 at 10:11, Ilya Chorny wrote:
> Hello
> 
> In the manual it says that by default sc_sigma = .3 nm.
> What C6 value does this correspond to. More specifically I have C6 set
> to 0.0. What will gromacs use as the C6 value in the soft core
> potential.
> 
> Thanks
> 
> Ilya




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