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Vagabond: bond-based parametrization reduces overfitting for refinement of proteins

Structural biology methods have delivered over 150 000 high-resolution structures of macromolecules, which have fundamentally altered our understanding of biology and our approach to developing new medicines. However, the description of molecular flexibility is instrinsically flawed and in almost al...

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Detalles Bibliográficos
Autor principal: Ginn, Helen M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8025884/
https://www.ncbi.nlm.nih.gov/pubmed/33825703
http://dx.doi.org/10.1107/S2059798321000826