Subject: Re: CCL:adding molecules to simulation box

From: "Mgr. Lubos Vrbka" <lubos.vrbka /a\ uochb.cas.cz>
Date: Fri, 04 Mar 2005 13:52:34 +0100

> Hi,
> You can do that with VMD. At the VMD console, type:
> package require autoionize
> autoionize
i am sorry, i probably wasn't clear enough - i need to add molecules and 
molecular ions to the box; from what i know, autoionize is capable of 
adding atomic ions only...

regards,
lubos

-- 
.....................................................
Mgr. Lubos Vrbka

Center for Biomolecules and Complex Molecular Systems
Institute of Organic Chemistry and Biochemistry
Academy of Sciences of the Czech Republic
Prague, Czech Republic
.....................................................