Charge distribution

From: Peterson J (peterson.jjjj_at_gmail.com)
Date: Fri Nov 01 2013 - 00:28:34 CDT

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Hi all,

I am planning to simulate neutral and positively charged forms of a drug
bound with a protein. How do cgenff parameters obtained from Paramchem deal
with charge distribution when it comes to positively charged molecule?

Thanks

Peterson

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