[gmx-users] micelle disaggregated in serial, but not parallel, runs using sd integrator
r.friedman at bioc.uzh.ch
Thu Feb 5 11:09:55 CET 2009
Berk Hess wrote:
> That I have thought about and it would avoid a lot of trouble.
> But I have not done that, because that would lead to different run results
> every time you rerun grompp, which can be misleading when you are
> trying to assess the effects of other parameters.
> But maybe the first issue is more important than the second?
That's how I feel. Many users may not be aware of potential artefacts.
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