VMD-L Mailing List
From: vani panguluri (vanipanguluri_at_gmail.com)
Date: Wed Mar 16 2011 - 23:06:45 CDT
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Hi all,
Can anyone suggest me a solution to find the Total binding energy using
NAMD .in the out file i got energy values individually for 100000 steps,but
i want to caluclate the total binding energy of the Ligand & Protein. please
suggest me a solution.
Thanks & Regards,
Vani Panguluri
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