Efficient affinity ranking of fluorinated ligands by 19F NMR: CSAR and FastCSAR
Author:
Funder
Eidgenössische Technische Hochschule Zürich
Publisher
Springer Science and Business Media LLC
Subject
Spectroscopy,Biochemistry
Link
http://link.springer.com/content/pdf/10.1007/s10858-020-00325-x.pdf
Reference48 articles.
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2. Boeszoermenyi A, Chhabra S, Dubey A et al (2019) Aromatic 19F–13C TROSY: a background-free approach to probe biomolecular structure, function, and dynamics. Nat Methods 16:333–340. https://doi.org/10.1038/s41592-019-0334-x
3. Casabianca LB, de Dios AC (2008) Ab initio calculations of NMR chemical shifts. J Chem Phys 128:052201. https://doi.org/10.1063/1.2816784
4. Dalvit C (2007) Ligand- and substrate-based 19F NMR screening: principles and applications to drug discovery. Prog Nucl Magn Reson Spectrosc 51:243–271. https://doi.org/10.1016/j.pnmrs.2007.07.002
5. Dalvit C (2009) NMR methods in fragment screening: theory and a comparison with other biophysical techniques. Drug Discov Today 14:1051–1057. https://doi.org/10.1016/j.drudis.2009.07.013
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