Dear Amber users and developers,
in my research project I am very interested in computing forces that
molecules experience because of electrostatic potential.
In order to compute them, I used pbsa utility ad implemented in amber tools.
I obtained a "force.dat" file, which contains three columns.
If I have understood correctly, this file contains forces in kcal/mol/A.
How can I visualize it with a molecule viewer? What is the meaning of
these 3 columns?
I would like to thank you in advance for your help.
Tommaso Casalini
CFA lab, Politecnico di Milano
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Received on Thu May 17 2012 - 05:30:03 PDT
