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Rappertk: a versatile engine for discrete restraint-based conformational sampling of macromolecules
BACKGROUND: Macromolecular structures are modeled by conformational optimization within experimental and knowledge-based restraints. Discrete restraint-based sampling generates high-quality structures within these restraints and facilitates further refinement in a continuous all-atom energy landscap...
Autores principales: | Gore, Swanand P, Karmali, Anjum M, Blundell, Tom L |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2007
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1847436/ https://www.ncbi.nlm.nih.gov/pubmed/17376228 http://dx.doi.org/10.1186/1472-6807-7-13 |
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