Hi All,
My problem is that I would like to perform a dihedral drive (from -180 to
160 by 20 degree increments) in a particular molecule, and I want to
generate PDB files for each of the 20 degree increments. Is there any way I
could do this using Leap ??? If not, any one know of any other program I
could use to get this done?
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Received on Sun Sep 21 2008 - 05:09:36 PDT
