Re: [AMBER] Partial Charges for Atom Types

From: Bill Ross <ross.cgl.ucsf.EDU>
Date: Wed, 9 Mar 2011 09:51:45 -0800

> Can you please help me where I can find partial charges for atom types in
> force field parameter files?

Each atom has a type and a charge. Atoms of the same type
typically have different charges. The atom type and charge
for each atom are defined in the residue template file, which
could be in prep, mol, or lib/off form.


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Received on Wed Mar 09 2011 - 10:00:04 PST
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