AMBER Archive (2004)

Subject: RE: AMBER: Questions about MD sampling

From: Ross Walker (ross_at_rosswalker.co.uk)
Date: Tue Oct 12 2004 - 12:31:12 CDT

Whoops, Make that
 
(24N+24)*S bytes
 
>The mdcrd file size will be roughly:
 
> (8N+24)*S bytes
 
> Where N is the number of atoms in your system and S is the number of
frames in the mdcrd file (nstep/ntwx).
 
 

 

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