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fitting procedure is used ([[Ferro et al. Act. Cryst. A. 1977]]). ([[Shoichet et al. J. Comp. Chem. 1992]]).

...nd in the receptor site. A least-squares fitting procedure is used (Ferro, et al Act. Cryst. A. 1977.). Once an orientation has been found, it is evaluat ...0 and higher are particularly useful for macromolecular docking (Shoichet, et al J. Mol. Biol. 1991) and applications which demand detailed exploration o

...nd Validation of a Modular, Extensible Docking Program: DOCK 5. submitted. 2006. ...timization of Nonpolar Contributions. J. Chem. Theory Comput . 2: 128-139, 2006

([[Moustakas et al., 2006]]). [[Ewing et al. 2001]].