Hello.
I have a question in xparmed.py.
I am using the command printangles in xparmed.py
I want to see only angles that contain both "1 and 2" with all the other
atoms. I am not sure how to set the mask for this
.1-2 or .1.2 implements atom 1 or atom 2. But I want .1 and .2.
Is this possible in parmed.py or cptraj
Thanks
Arun
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Received on Wed Sep 24 2014 - 07:00:03 PDT