CCL: A review of force fields



 Sent to CCL by: "Eric M. Bennett" [benne278=umn.edu]
 Jeffrey L. Nauss wrote:
 
 I find these references useful for small molecule comparisons.
 Gundertofte et al. J. Comp. Chem. 1996, 17:429-49
 Pettersson & Liljefors Rev. Comp. Chem. 1996, 9:167-90
 Nicklaus, J. Comp. Chem. 1997, 18:1056-60
 Halgren, J. Comp. Chem. 1999, 20:730-748
 For proteins there is also this reference:
 Price DJ, Brooks CL, III. 2002. Modern protein force fields behave
 comparably in molecular dynamics simulations. J Comp Chem 23: 1045
 
 Another good paper is
 Beachy et al, JACS 1997, 119, 5908-5920
 --
 Eric Bennett
 Center for Drug Design, University of Minnesota
 http://www.cdd.umn.edu