4.6 Article

Product formation in rhodopsin by fast hydrogen motions

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PHYSICAL CHEMISTRY CHEMICAL PHYSICS
卷 13, 期 9, 页码 3645-3648

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ROYAL SOC CHEMISTRY
DOI: 10.1039/c0cp02496a

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  1. PRIN programme [2008JKBBK4]

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The photochemical cis-trans isomerization of retinal in rhodopsin is investigated by structure sampling and excited state QM/MM trajectories with surface hopping. The calculations uncover the motions responsible for photoproduct formation and elucidate the reasons behind the efficient photoisomerization in the primary event of visual transduction.

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