Hi,
Can anyone guide me, how to calculate the binding energy of specific residues of a certain protein by using Amber tools?
Thanks in advance.
Hi Numan,
The following link should help you:
https://ambermd.org/tutorials/advanced/tutorial3/py_script/section6.php
Dear Numan,
This link might help you.
https://www.researchgate.net/post/How-to-calculate-the-individual-residue-contribution-in-a-protein-ligand-interaction
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