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An Efficient Algorithm to Perform Local Concerted Movements of a Chain Molecule

The devising of efficient concerted rotation moves that modify only selected local portions of chain molecules is a long studied problem. Possible applications range from speeding the uncorrelated sampling of polymeric dense systems to loop reconstruction and structure refinement in protein modeling...

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Detalles Bibliográficos
Autores principales: Zamuner, Stefano, Rodriguez, Alex, Seno, Flavio, Trovato, Antonio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4380501/
https://www.ncbi.nlm.nih.gov/pubmed/25825903
http://dx.doi.org/10.1371/journal.pone.0118342