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Reducing Ensembles of Protein Tertiary Structures Generated De Novo via Clustering

Controlling the quality of tertiary structures computed for a protein molecule remains a central challenge in de-novo protein structure prediction. The rule of thumb is to generate as many structures as can be afforded, effectively acknowledging that having more structures increases the likelihood t...

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Detalles Bibliográficos
Autores principales: Zaman, Ahmed Bin, Kamranfar, Parastoo, Domeniconi, Carlotta, Shehu, Amarda
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7248879/
https://www.ncbi.nlm.nih.gov/pubmed/32397410
http://dx.doi.org/10.3390/molecules25092228