|Molecular Docking Server
|Lipid as a ligand
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|Author:||pufspufs [ Thu Oct 22, 2009 2:06 pm ]|
|Post subject:||Lipid as a ligand|
I am trying to dock a lipid into a protein. does anybody know the best charge and geometry optimization for such a molecule.
Thank you very much.
|Author:||bikadi [ Thu Oct 22, 2009 3:02 pm ]|
|Post subject:||Re: Lipid as a ligand|
MMFF optimization and PM6 charges should be fine.
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