Dear sir,
In my simulation I have a metal atom. Over the simulation, the number of
water atoms around the metal change.
I want to calculate the number of water atoms within 6 angstrom radius of
the metal in every frame.
How to do that with cpptraj?
thanks in advance
*Debodyuti Dutta*
Research Scholar
Indian Institute of Technology Kharagpur
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Received on Wed May 24 2017 - 05:00:02 PDT
