Re: Mg++2 parameters



 I recently asked a question about MM parameters for
 Mg++2. Many thanks to all who responded.  The
 consensus is that the best are in:
  J. Aqvist, Ion-Water Interaction Potentials Derived from Free Energy
  Perturbation Simulations, J. Phys. Chem. (1990), 94, 8021-8024.
 However, be warned if you do a CAS search on Aqvist
 (as I did at the start of all this) the name is mispelled
 as Aaqvist for this particular paper, proving once again that
 our answers are only as good as our databases.....
 p.s.  If anyone from CAS is watching, feel free to
       correct this error.
                                       Dave
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 David Hartsough                       dave &$at$& wh.bayer.com
 Structural Chemistry
 Bayer Research Center
 400 Morgan Lane                       Phone: (203)937-2982
 West Haven CT 06516                   Fax:   (203)937-2650
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 The opinions expressed herein are solely those of the author
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