On Tue, May 25, 2004, Jiten wrote:
>
> I am wondering if the free energies calcaulations in sander (amber8) would
> be possible with the octahedron peroidic box (Non-orthognal systems ) unlike
> in gibbs( amber7) accepts orthogonal systems only.
Yes, sander can do free energies with the truncated octahedral box.
....dac
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Received on Tue May 25 2004 - 05:53:01 PDT
