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How good is a Broyden-Fletcher-Goldfarb-Shanno-like update Hessian formula to locate transition structures? Specific reformulation of Broyden-Fletcher-Goldfarb-Shanno for optimizing saddle points.

Josep Maria AngladaJosep Maria Bofill
Published in: J. Comput. Chem. (1998)
Keyphrases
  • saddle points
  • convergence analysis
  • scale space
  • image processing
  • hidden markov models
  • step size