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Molecular Structure Refinement Based on Residual Dipolar Couplings: A Comparison of the Molecular Rotational-Sampling Method with the Alignment-Tensor Approach.

Maria PechlanerWilfred F. van GunsterenLorna J. SmithBartosz StankiewiczLukas N. WirzNiels Hansen
Published in: J. Chem. Inf. Model. (2024)
Keyphrases
  • molecular structure
  • high order
  • data sets
  • neural network
  • image sequences
  • higher order
  • three dimensional
  • motion estimation
  • image registration
  • camera motion
  • degrees of freedom
  • refinement process