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Hybrid Dynamics Simulation Engine for Metalloproteins
Quality computational description of metalloproteins is a great challenge due to the vast span of time- and lengthscales characteristic of their existence. We present an efficient new method that allows for robust characterization of metalloproteins. It combines quantum mechanical (QM) description o...
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| Main Authors: | , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
The Biophysical Society
2012
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3443785/ https://ncbi.nlm.nih.gov/pubmed/22947938 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2012.06.024 |
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