Subject: Re: CCL:Gasteiger charges and Babel

From: Jianquan Chen <[email-masked]>
Date: Wed, 17 Jul 2002 13:43:16 -0400 (EDT)

add -charge switch to babel command line.
Good luck.

jianquan chen
Rutgers Univ.
On Thu, 11 Jul 2002, Carsten Detering wrote:

> Dear CCLers,
> 
> I wonder how it is possible to assign Gasteiger charges to structures with
> Babel. I looked on the web site and in the manual, but couldn't find a hint.
> Would someone be so kind and point out to me how that works??
> Thanks a lot in advance,
> 
> Carsten
> 
> 
> 
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