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Molecular Dynamics Simulations Using Temperature-Enhanced Essential Dynamics Replica Exchange
Today's standard molecular dynamics simulations of moderately sized biomolecular systems at full atomic resolution are typically limited to the nanosecond timescale and therefore suffer from limited conformational sampling. Efficient ensemble-preserving algorithms like replica exchange (REX) ma...
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| Huvudupphovsmän: | , |
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| Materialtyp: | Artigo |
| Språk: | Inglês |
| Publicerad: |
Biophysical Society
2007
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| Ämnen: | |
| Länkar: | https://ncbi.nlm.nih.gov/pmc/articles/PMC1877756/ https://ncbi.nlm.nih.gov/pubmed/17384062 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.106.103101 |
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