[AMBER] coordination number

From: DEBOSTUTI GHOSHDASTIDAR <debostutighosh.gmail.com>
Date: Wed, 10 Aug 2011 18:16:47 +0530

Hi all

I have a doubt regarding calculating the number of water molecules within
the first solvation shell of a molecule. Can I do so directly from the ptraj
output of rdf?
Thanks in advance for your suggestions

-- 
Debostuti Ghosh Dastidar
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Received on Wed Aug 10 2011 - 06:00:05 PDT