Re: [AMBER] how to change the charge in all_amino94.lib

From: Bill Ross <ross.cgl.ucsf.EDU>
Date: Wed, 3 Nov 2010 13:29:25 -0700

> Do I miss anything?

By changing the charges in a standard residue library, you are risking
accidentally using the modified residue down the road.

Also, if you plan to publish, you might want to do something more
defensible than manual concoction of charges.


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Received on Wed Nov 03 2010 - 13:30:04 PDT
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