[AMBER] leap and centering

From: Hannes Loeffler <Hannes.Loeffler.stfc.ac.uk>
Date: Fri, 13 Mar 2015 15:20:35 +0000

Hi,

in a sequence like this

p = loadpdb foo.pdb
solvateBox p TIP3PBOX
saveAmberParm p solvated.parm7 solvated.rst7
savepdb p solvated.pdb

why is the origin in solvated.pdb in the box center contrary to the
inpcrd file?


Many thanks,
Hannes.

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Received on Fri Mar 13 2015 - 08:30:02 PDT
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