Re: [AMBER] how to make active site conserve water unique before loading pdb on xleap?

From: David A Case <>
Date: Fri, 8 Jan 2016 09:01:54 -0500

On Thu, Jan 07, 2016, Saman Yousuf ali wrote:

> I want to run MD, but my problem is conserve water of my target protein
> active site. Six conserve water molecules are present in active
> site. When I load complex pdb on xleap, then after adding sovatebox
> and saving prmtop, inpcrd, active site conserve water of my target pdb
> lost. I cant identify them

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Received on Fri Jan 08 2016 - 06:30:05 PST
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