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Going beyond Clustering in MD Trajectory Analysis: An Application to Villin Headpiece Folding
Recent advances in computing technology have enabled microsecond long all-atom molecular dynamics (MD) simulations of biological systems. Methods that can distill the salient features of such large trajectories are now urgently needed. Conventional clustering methods used to analyze MD trajectories...
| Autores principales: | , , |
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| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
Public Library of Science
2010
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2855342/ https://www.ncbi.nlm.nih.gov/pubmed/20419160 http://dx.doi.org/10.1371/journal.pone.0009890 |