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Development of a group contribution method for estimating free energy of peptides in a dodecane-water system via molecular dynamic simulations.

Camilo Andrés Mora OsorioAndrés Fernando González Barrios
Published in: BMC Bioinform. (2016)
Keyphrases
  • similarity measure
  • objective function
  • pairwise
  • model selection
  • free energy
  • prior knowledge
  • segmentation method
  • closed form
  • fixed point