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Performance efficient macromolecular mechanics via sub-nanometer shape based coarse graining

Dimensionality reduction via coarse grain modeling is a valuable tool in biomolecular research. For large assemblies, ultra coarse models are often knowledge-based, relying on a priori information to parameterize models thus hindering general predictive capability. Here, we present substantial advan...

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Detalles Bibliográficos
Autores principales: Bryer, Alexander J., Rey, Juan S., Perilla, Juan R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10086035/
https://www.ncbi.nlm.nih.gov/pubmed/37037809
http://dx.doi.org/10.1038/s41467-023-37801-5