Hi!
I have a MD trajectory wit water, protein and one other compound. I am
interested in the enthalpy of the protein only over each frame the
trajectory.
I believe there must be some command in cpptraj or other AMBER modules
which can be of help to me. I tried finding it but am still unable to
locate it.
I also tried old archives of amber mailing list but the answer still
eludes me.
Please help.
Abhilash
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Received on Sun Dec 28 2014 - 00:00:02 PST
