[gmx-users] Re: how to turn off the interamolecular interaction
Mark.Abraham at anu.edu.au
Wed Nov 19 17:39:43 CET 2008
xianghong qi wrote:
> Hi, Mark,
> Which method can work with exclusion? Could you give me some hints for
> that? Thanks again.
I'm not your free teacher... :-) You need to have a much better working
knowledge of MD than one such that you need to ask that question.
Certainly with your present knowledge, it seems you should not be
attempting some study where you're turning off some interactions for
some unknown purpose. The first few chapters of the GROMACS manual are a
great place to start, and you won't get anywhere without them.
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