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Efficient Sampling of Knotting-Unknotting Pathways for Semiflexible Gaussian Chains
We propose a stochastic method to generate exactly the overdamped Langevin dynamics of semi-flexible Gaussian chains, conditioned to evolve between given initial and final conformations in a preassigned time. The initial and final conformations have no restrictions, and hence can be in any knotted s...
Spremljeno u:
| Izdano u: | Polymers (Basel) |
|---|---|
| Glavni autori: | , |
| Format: | Artigo |
| Jezik: | Inglês |
| Izdano: |
MDPI
2017
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| Teme: | |
| Online pristup: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6432015/ https://ncbi.nlm.nih.gov/pubmed/30970873 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/polym9060196 |
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