AMBER Archive (2004)

Subject: Re: AMBER: About RESP Calculation

From: FyD (fyd_at_u-picardie.fr)
Date: Fri Mar 19 2004 - 14:30:00 CST

> but as far as I understood, it is not possible because of the
> orientation problem of the molecule at interest.

The question is not "to be possible" or "not be possible to"... the question is
the reproducibility of the published charges, that's it... F.
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu