AMBER Archive (2003)

Subject: Re: AMBER: atmtypenumbers for halogens

From: Giulio Rastelli (rastelli.giulio_at_unimo.it)
Date: Fri Nov 14 2003 - 09:00:41 CST


Dear Thomas, I would appreciate if you could forward to me private
answers to your question...thanks
Giulio

Thomas.Fox_at_bc.boehringer-ingelheim.com wrote:
> Hi,
>
> has anybody a version of atmtypenumbers handy which contains radii for the
> halogens?
> Are there values generally agreed upon at all?
>
> Any help appreciated,
> Th.
>
> Dr. Thomas Fox
> Dept. Lead Discovery - Computer Aided Molecular Design
> K91-00-10
> Boehringer Ingelheim Pharma GmbH & Co KG
> 88397 Biberach, Germany
> thomas.fox_at_bc.boehringer-ingelheim.com
>
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-- 

Giulio Rastelli Dipartimento di Scienze Farmaceutiche Universita di Modena e Reggio Emilia Via Campi 183 41100 Modena - ITALY ------------------------------------- tel 0039-059-2055145 fax 0039-059-2055131 -------------------------------------

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