Arneh Babakhani wrote:
Hi ,
I'd like to use g_covar to calculate the average structure of a
trajectory. But at the moment, I'm not interested in any of the eig.
value/vector data (which takes a considerable amount of time to calculate).
Was wondering: Is there a way to suppress the eig. value/vector/covar
matrix calculations when using g_covar, and only use it to calculate the
average structure? Or, is there another tool/method for calculating
average structures from trajectories?
Thanks,
use g_rmsf instead
Arneh
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