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Systematic Multiscale Parameterization of Heterogeneous Elastic Network Models of Proteins
We present a method to parameterize heterogeneous elastic network models (heteroENMs) of proteins to reproduce the fluctuations observed in atomistic simulations. Because it is based on atomistic simulation, our method allows the development of elastic coarse-grained models of proteins under differe...
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| Main Authors: | , , |
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| Format: | Artigo |
| Language: | Inglês |
| Published: |
The Biophysical Society
2008
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| Subjects: | |
| Online Access: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2567941/ https://ncbi.nlm.nih.gov/pubmed/18658214 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.108.139733 |
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