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Path-sampling strategies for simulating rare events in biomolecular systems
Despite more than three decades of effort with molecular dynamics simulations, long-timescale (ms and beyond) biologically relevant phenomena remain out of reach in most systems of interest. This is largely because important transitions, such as conformational changes and (un)binding events, tend to...
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| Publicado no: | Curr Opin Struct Biol |
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| Main Authors: | , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2016
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5420491/ https://ncbi.nlm.nih.gov/pubmed/27984811 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.sbi.2016.11.019 |
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