Re: [AMBER] nfft1-3 too large! check on MAXNFFT in ew_bspline.f

From: Bill Ross <ross.cgl.ucsf.EDU>
Date: Tue, 8 Jun 2010 11:07:19 -0700

> I am doing a Simulation of a DNA (240-mer) using AMBER9.

Note that the default box that is created when solvating such a
long solute might need to be extra large in case any distortions
develop.

Bill

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Received on Tue Jun 08 2010 - 11:30:03 PDT
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