Cargando…

Water Networks in Complexes between Proteins and FDA-Approved Drugs

[Image: see text] Water molecules at protein–ligand interfaces are often of significant pharmaceutical interest, owing in part to the entropy which can be released upon the displacement of an ordered water by a therapeutic compound. Protein structures may not, however, completely resolve all critica...

Descripción completa

Detalles Bibliográficos
Autores principales: Samways, Marley L., Bruce Macdonald, Hannah E., Taylor, Richard D., Essex, Jonathan W.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9832485/
https://www.ncbi.nlm.nih.gov/pubmed/36469670
http://dx.doi.org/10.1021/acs.jcim.2c01225