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Close agreement between the orientation dependence of hydrogen bonds observed in protein structures and quantum mechanical calculations

Hydrogen bonding is a key contributor to the exquisite specificity of the interactions within and between biological macromolecules, and hence accurate modeling of such interactions requires an accurate description of hydrogen bonding energetics. Here we investigate the orientation and distance depe...

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Detalhes bibliográficos
Main Authors: Morozov, Alexandre V., Kortemme, Tanja, Tsemekhman, Kiril, Baker, David
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2004
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC406446/
https://ncbi.nlm.nih.gov/pubmed/15118103
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0307578101
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