Re: still having ptraj problems

From: Jake Isaacs <rjisaa0_at_uky.edu>
Date: Wed 22 May 2002 11:50:11 -0400

The problem seems to stem from including "reference" as the mode in the rms
command. Without it, everything works fine. Does anyone see what the
problem might be? Is there another way to compute the rms from the average?
 
>> trajin dna.crd 1001 2000 1
>> reference dna-avg.crd
>> rms reference mass out dna-rms.out *
>> trajout dna1001-2000-rms.crd
>> go


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Received on Wed May 22 2002 - 08:50:11 PDT
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