Hello Amber community,
I am trying to use the new cpptraj remlog command to extract the roundtrip
times and % exchange of my T-REMD rounds. While the 'out' and 'reptime'
parameters work just fine, the 'stats' parameter prints out a file full of
0s for all the fields (except CRDIDX). The commands I am using is:
readdata ../mdout/remd1.log name log1
remlog log1 stats statsout ../analysis/remd1_stats.dat
Is this a known bug in cpptraj or am I somehow misusing the command?
Thank you,
Eugene Yedvabny
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Received on Mon Jun 02 2014 - 17:30:03 PDT
