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The color of rhodopsins at the ab initio multiconfigurational perturbation theory resolution
We demonstrate that “brute force” quantum-mechanics/molecular-mechanics computations based on ab initio (i.e., first principles) multiconfigurational perturbation theory can reproduce the absorption maxima of a set of modified bovine rhodopsins with an accuracy allowing for the analysis of the facto...
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| Main Authors: | , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
National Academy of Sciences
2006
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC1859901/ https://ncbi.nlm.nih.gov/pubmed/17090682 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0604048103 |
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