AMBER Archive (2005)

Subject: Re: AMBER: question about grid in ptraj

From: Angelo Pugliese (angelo_at_holmes.cancres.nottingham.ac.uk)
Date: Fri Oct 07 2005 - 04:23:17 CDT


Good question,

I wish to know the same thing, I cannot understand the AMBER 8 manual
very clearly.

Angelo

Linchen Gong wrote:

>Hello everyone,
>I want to know the meaning of output data generated by grid command in ptraj.
>for example, if I have
>"grid dense_out 70 1 70 1 70 1 :WAT max 0.5"
>in my input file for ptraj
>what is the physical meaning of output density
>
>I don't know whether I have put it clear.
>Thanks a lot!
>
>______________________________________
>Linchen Gong
>basic science class
>math and physics oriented
>Department of physics
>Tsinghua University
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