@TechReport{karney05c,
  author =       {Charles F. F. Karney and Jason E. Ferrara and
                  Clay D. Spence},
  title =        {Using Binding Free Energy to Guide Ligand Design},
  institution =  {Sarnoff Corp.},
  year =         2005,
  month =        nov,
  eprint =       {physics/0511061},
  abstract =     {The molecular distributions obtained from canonical
                  Monte Carlo simulations can be used to find an
                  approximate interaction energy.  This serves as the
                  basis of a method for estimating the binding free
                  energy for a ligand to a protein which enables the
                  free energy to be used to direct the design of ligands
                  which bind to a protein with high affinity.}
}