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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...
Autores principales: | Zamuner, Stefano, Rodriguez, Alex, Seno, Flavio, Trovato, Antonio |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Public Library of Science
2015
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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 |
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