[gmx-users] coordinates in xtc vs. trr when using xtc_grps

Mark Abraham Mark.Abraham at anu.edu.au
Wed Jun 21 19:06:56 CEST 2006


YOLANDA SMALL wrote:

> Is this a bug when usig the xtc_grps option or is there some sort of
> transformation being done on the coordinates in the xtc file? 

Well, yes, it is a lossy compression format. I'm not sure if this 
accounts for your observations or not.

Mark



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