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Atomistic understanding of kinetic pathways for single base-pair binding and unbinding in DNA
We combine free-energy calculations and molecular dynamics to elucidate a mechanism for DNA base-pair binding and unbinding in atomic detail. Specifically, transition-path sampling is used to overcome computational limitations associated with conventional techniques to harvest many trajectories for...
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| Veröffentlicht in: | Proc Natl Acad Sci U S A |
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| Hauptverfasser: | , , , |
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
National Academy of Sciences
2003
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.govhttps://pmc.ncbi.nlm.nih.gov/articles/PMC283522/ https://ncbi.nlm.nih.govhttps://pubmed.ncbi.nlm.nih.gov/14617777/ https://ncbi.nlm.nih.govhttps://doi.org/10.1073/pnas.2036378100 |
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