i think the question was about how the glycam OLP/HYP charges were derived.
did they use REDDB?
maybe a glycam person can add info here...
if it was just about how it has been done in general, the work by Pande and
others on HYP could be a good place to start, it's been published
On Wed, Feb 24, 2010 at 9:20 AM, FyD <fyd.q4md-forcefieldtools.org> wrote:
> Dear Emmanuel,
>
> Can someone please point me in the direction if a reference for the charge
>> derivation protocol employed in getting charges for OLP, HYP in the
>> GLYCAM
>> forcefield?
>>
>
> You might look at the "F-85" R.E.DD.B. project (among many others) where
> you will find references & examples/discussions about charge derivation.
>
> regards, Francois
>
>
>
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Received on Wed Feb 24 2010 - 06:30:06 PST
