Re: AMBER: Select specific residues (leap)

From: FyD <>
Date: Mon, 31 Mar 2008 12:31:39 +0200

Quoting Marta Rossini <>:

> I want to relax specific residues in a protein, but it's very
> complicate to select them manually using xleap interface. Is there a
> command to select specific residues (es: ALA32) in xleap or in
> tleap too (since the function "relax" has been included in tleap)
> and include them into a unit?

Please see:

regards, Francois

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Received on Fri Apr 18 2008 - 21:15:31 PDT
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