AMBER Archive (2007)

Subject: AMBER: CONFIGURATION FILE FOR OXALATE C2O4^2-

From: Eduardo Mendez (pckboy_at_gmail.com)
Date: Mon Sep 17 2007 - 21:32:22 CDT


Greetings Amber users

I was wondering if anyone could share the amber parameter files for
oxalate. I did gaussian calculations to get the mulliken charges,
however, to my dismay, gaussian gives me an isomer, which
is not in the planar conformation one would expect it to be :(
Any idea were can I find a library site other than
http://pharmacy.man.ac.uk/amber/ ???

Thanks in advance

eduardo
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