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A Geometric Definition of Short to Medium Range Hydrogen-Mediated Interactions in Proteins

We present a method to rapidly identify hydrogen-mediated interactions in proteins (e.g., hydrogen bonds, hydrogen bonds, water-mediated hydrogen bonds, salt bridges, and aromatic π-hydrogen interactions) through heavy atom geometry alone, that is, without needing to explicitly determine hydrogen at...

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Detalles Bibliográficos
Autores principales:	Merski, Matthew, Skrzeczkowski, Jakub, Roth, Jennifer K., Górna, Maria W.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2020
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7696500/ https://www.ncbi.nlm.nih.gov/pubmed/33203097 http://dx.doi.org/10.3390/molecules25225326

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