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Molecular Dynamics Simulation of Lysozyme Adsorption/Desorption on Hydrophobic Surfaces
In this work we present a series of fully atomistic molecular dynamics (MD) simulations to study lysozyme’s orientation-dependent adsorption on polyethylene (PE) surface in explicit water. The simulations show that depending on the orientation of the initial approach to the surface the protein may a...
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| Autors principals: | , , |
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| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
2012
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3548063/ https://ncbi.nlm.nih.gov/pubmed/22882159 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp304057e |
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