Dear Naveen Samala,
> Can you please provide me information about how to add new multi-atom
> residue (ligand) including partial charges? Are there any tutorials
> available anywhere about new residue addition?
For charge derivation for new molecules and molecular fragments, you
could see
http://q4md-forcefieldtools.org/Tutorial/
regards, Francois
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Received on Tue Mar 15 2011 - 00:00:03 PDT
