Cargando…

When are two hydrogen bonds better than one? Accurate first-principles models explain the balance of hydrogen bond donors and acceptors found in proteins

Hydrogen bonds (HBs) play an essential role in the structure and catalytic action of enzymes, but a complete understanding of HBs in proteins challenges the resolution of modern structural (i.e., X-ray diffraction) techniques and mandates computationally demanding electronic structure methods from c...

Descripción completa

Detalles Bibliográficos
Autores principales: Vennelakanti, Vyshnavi, Qi, Helena W., Mehmood, Rimsha, Kulik, Heather J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8908278/
https://www.ncbi.nlm.nih.gov/pubmed/35382134
http://dx.doi.org/10.1039/d0sc05084a