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Hydration structure of human lysozyme investigated by molecular dynamics simulation and cryogenic X-ray crystal structure analyses: On the correlation between crystal water sites, solvent density, and solvent dipole.

Junichi HigoMasayoshi Nakasako
Published in: J. Comput. Chem. (2002)
Keyphrases
  • x ray
  • molecular dynamics
  • x ray images
  • database systems
  • data collection
  • intraoperative