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CHARMM Force-Field Parameters for Morphine, Heroin, and Oliceridine, and Conformational Dynamics of Opioid Drugs.

Thomas GiannosSamo LesnikUrban BrenMilan HodoscekTatiana DomratchevaAna-Nicoleta Bondar
Published in: J. Chem. Inf. Model. (2021)
Keyphrases
  • force field
  • maximum likelihood
  • parameter estimation
  • active contour model
  • multiscale
  • markov random field
  • scale space
  • active contours
  • information theory
  • coarse grained
  • external force