On 10/28/2012 05:52 PM, Christopher Neale wrote:
I thought you said that you have 1000 structures. It seems like you only have
6? Nevertheless, I am glad that trjcat worked for you.
I don't know what is going on with your RMSD values, but I suggest that you
start a separate post with a new subject line for that. I suspect that you need
to do some fitting.
Chris.
thank you for kind reply. I just use 6 for testing.
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