[AMBER] How to have a certain number of water molecules?

From: Azade Yazdan Yar <azade.yazdanyar.gmail.com>
Date: Tue, 20 Dec 2016 16:39:07 +0100

Hello,

I am trying to build several boxes which contain different residues. I
would like to have the same number of water molecules in all boxes.
Is there any easy way to do this? (the 'solvatebox' command is not very
number-orientated)

And my second question is: Imagine I have used the 'solvatebox' command on
my residue. Is there any way to now undo this? e.g. remove the added water
molecules from the box?

Thanks for your help,
Azade
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Received on Tue Dec 20 2016 - 08:00:03 PST
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