[gmx-users] Confusion Regarding Vacuum

csreddy at ncbs.res.in csreddy at ncbs.res.in
Mon Nov 26 13:36:46 CET 2007

Dear All,
I am a bit confused regarding  Vacuum. I wanted to do EM in Vacuum. I
think I can proceed either of the below...

1) I create a box (editconf) and place a molecule with out solvent.
2) Never create a box, then proceed other steps as usual like EM etc.

Can we call 2nd option also a vacuum and what is more appropriate?


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