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Molecular modeling for Cu(II)-aminopolycarboxylate complexes: Structures, conformational energies, and ligand binding affinities.

Marina CendicZoran D. MatovicRobert J. Deeth
Published in: J. Comput. Chem. (2013)
Keyphrases
  • hiv protease
  • molecular structure
  • graph cuts
  • pairwise
  • drug discovery
  • drug design
  • higher order
  • protein protein interactions
  • sequence analysis
  • dna computing
  • protein protein
  • virtual screening