Dear,
We can decompose energies into residues contributions from groups in
MM-PBSA . I wonder if the ligand must be peptide or protein because the
software needs to know which atoms belong to backbone and which belong
to sidechain? The protein-protein complex Ras-Raf is studied in the
reference article from Holger Gohlke. Are there some examples about
nonpeptide-protein complex?
Thanks in advance.
Tong
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Received on Sun Apr 23 2006 - 06:07:06 PDT
