[AMBER] cpptraj: format of diagmatrix output

From: Marc van der Kamp <marcvanderkamp.gmail.com>
Date: Thu, 20 Oct 2016 12:20:04 +0100

Hi,

This may be a naive question, but I couldn't find the answer to it easily
in the manual or mailing list:
What is the format of the diagmatrix output?
In particular, I would like to find the eigenvalues for each of the
principal components from a PCA analysis.

Thanks!
Marc
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Received on Thu Oct 20 2016 - 04:30:03 PDT