NMR Screening
  • SAR by NMR: (see Chemical Shift Perturbation in Biomolecular complexes).
  • Affinity NMR: based on translational diffusion differences. Examples are the NOE pumping experiment ( 98JACS10258 and 03JAFC1988 ).
  • Change of relaxation properties
  • Interligand NOEs. A particular example is the Reverse NOE pumping experiment.
  • Transferred NOEs
  • Saturation Transfer Difference
  • Spin-labels
  • WATER-LOGSY experiment: The large bulk water magnetization is partially transferred via the protein-ligand complex to the free ligand.
  • 19F NMR Experiments: 03JACS7696 and 03JACS14620
    • Biomolecular complexes
  • Protein-Drug
  • DNA-Drug
  • RNA-Drug
    • General Reading
  • NMR in drug discovery ( 00DDT230 , 99QRB211 , 02PROG187 and 04CR3641 )
  • Drug metabolism studied using NMR ( 00ENC375 )
  • NMR based approaches for lead generation in drug discovery ( 01METH202 , 05METH549 and 05METH571 )
  • Flow-injection NMR techniques in drug discovery ( 01METH230 )
  • Determining the overall size of small molecules mistures for high troughput NMR screening ( 05JB243-31 )

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