Sorry, mistake in the previous post, it should read:
"I would like to select atoms within a 5A distance from :4.SG, but they should be only
COs"
________________________________
From: Krisztina Fehér <Krisztina.Feher.UGent.be>
To: amber.ambermd.org
Sent: Friday, July 4, 2014 1:49 PM
Subject: [AMBER] Fwd: neighbours around an atom
Another question would be how to combine the distance-based selection
with and atom name for extracting distances: e.g. I would like to
select atoms within a 5A distance from :4.CB, but they should be only
COs. I tried:
distance 4SG :4.SG .CO&:4.SG<:5.0 out 4SG.dist noimage
or
distance 4SG :4.SG :4.SG<:5.0&.CO out 4SG.dist noimage
but these were not recognised.
Thanks for any help,
Krisztina
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Received on Fri Jul 04 2014 - 05:30:02 PDT
