Subject: gaussian charge calculation

From: Zhou Feng <[email-masked]>
Date: Sun, 25 Sep 94 14:55:53 -0500

Dear all:

         We have performed a charge calculation using the program  GAUSSIAN92 (6-31G,   
AM1),   the charges calculated seems somewhat larger than the charges given in  
commerical packages such  as CHARMm.    Can anybody tell me is that a convention to  
rescale the charges given by GAUSSIAN  to compare with other programs such as  
MOPAC?    What  should be  the scaling factor?

        Thank you.

---
		Feng Zhou

+--------------------------------------------------------------------
|Theoretical Biophysics 		[email-masked]
|University of Illinois			Tel: (217)-244-1612
|3121 Beckman Institute			Fax: (217)-244-6078
|405 N Mathews, Urbana, IL61801		NeXTmail Ok
+--------------------------------------------------------------------