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Transferable aspherical atom model refinement of protein and DNA structures against ultrahigh-resolution X-ray data

In contrast to the independent-atom model (IAM), in which all atoms are assumed to be spherical and neutral, the transferable aspherical atom model (TAAM) takes into account the deformed valence charge density resulting from chemical bond formation and the presence of lone electron pairs. Both model...

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Detalhes bibliográficos
Publicado no:Acta Crystallogr D Struct Biol
Main Authors: Malinska, Maura, Dauter, Zbigniew
Formato: Artigo
Idioma:Inglês
Publicado em: International Union of Crystallography 2016
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4908868/
https://ncbi.nlm.nih.gov/pubmed/27303797
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1107/S2059798316006355
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