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Deep UV Resonance Raman Spectroscopy of β-Sheet Amyloid Fibrils; A QM/MM Simulation
We present a combined quantum mechanics and molecular mechanics (QM/MM) study of the deep ultraviolet ππ* resonance Raman spectra of β-sheet amyloid fibrils Aβ(34–42) and Aβ(1–40). Effects of conformational fluctuations are described using a Ramachandran angle map (RAM), thus avoiding repeated ab-in...
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| Autori principali: | , , |
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| Natura: | Artigo |
| Lingua: | Inglês |
| Pubblicazione: |
2011
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| Soggetti: | |
| Accesso online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3233492/ https://ncbi.nlm.nih.gov/pubmed/22007849 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp207849u |
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