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Molecular dynamics-based approaches for enhanced sampling of long-time, large-scale conformational changes in biomolecules
The rugged energy landscape of biomolecules together with shortcomings of traditional molecular dynamics (MD) simulations require specialized methods for capturing large-scale, long-time configurational changes along with chemical dynamics behavior. In this report, MD-based methods for biomolecules...
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Formato: | Texto |
Lenguaje: | English |
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Biology Reports Ltd
2009
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2948272/ https://www.ncbi.nlm.nih.gov/pubmed/20948633 http://dx.doi.org/10.3410/B1-51 |