Dear all,
I performed a cluster analysis using ptraj from the AmberTools
distribution, that worked quite well.
However, I did not find any hint in the resulting pdb files of the
cluster centers to what snapshot of the original trajectory they
correspond.
Is this information printed in any of the other output files?
Thanks in advance,
Anselm
Bioinformatik
Friedrich-Alexander-Universität
Erlangen-Nürnberg
Germany
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Received on Sun Jul 27 2008 - 06:07:05 PDT
