Dear Sir/Madam,
I could like to calculate the RESP for a Platinum complex, so that I can
input this information to amber for further calculation. I have done the
optimization with Gaussian already.
However, I found RESP can only be done for atoms with Z<35, does it mean
that I cannot use RED/RESP to calculate the charge for a Platinum complex,
if yes, could you mind to teach me what is the best way of doing this?
Many thanks in advanced!
Annie
_________________________________________________________________
Learn English via Shopping Game, FREE!
http://www.linguaphonenet.com/BannerTrack.asp?EMSCode=MSN06-03ETFJ-0211E
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Sun Aug 27 2006 - 06:07:11 PDT
