Hi Russel,
just use the "solvateOct" command instead of the "solvateBox" command. It is
described in the AmbterTools manual. Most (all?) tutorials from the AMBER
homepage seem to use boxes ... but a truncated octahedron works equally.
Alex
________________________________
Von: Bertrand Russell <russell.iitm.gmail.com>
An: amber.ambermd.org
Gesendet: Donnerstag, den 18. November 2010, 8:44:07 Uhr
Betreff: [AMBER] Truncated Octahedron Box in Amber9
Dear Amber Users,
I am a novice in Amber and Molecular Dynamics
Simulations. I wonder is it possible to setup a truncated octahedron box
using tleap? If so could someone shed some light on how or point out some
tutorial?
I would be very kind to you.
With Kind regards,
Russell
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Received on Thu Nov 18 2010 - 01:00:04 PST
