Nuclear magnetic resonance free ligand conformations and atomic resolution dynamics

Knowledge of free ligand conformational preferences (energy minima) and conformational dynamics (rotational energy barriers) of small molecules in solution can guide drug design hypotheses and help rank ideas to bias syntheses towards more active compounds. Visualization of conformational exchange d...

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Detalles Bibliográficos
Autores principales: Balazs, Amber Y. S., Davies, Nichola L., Longmire, David, Packer, Martin J., Chiarparin, Elisabetta
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Copernicus GmbH 2021
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10539760/
https://www.ncbi.nlm.nih.gov/pubmed/37904764
http://dx.doi.org/10.5194/mr-2-489-2021

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10539760/
https://www.ncbi.nlm.nih.gov/pubmed/37904764
http://dx.doi.org/10.5194/mr-2-489-2021

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