(Q50943308)

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Optical spectra of Cu(II)-azurin by hybrid TDDFT-molecular dynamics simulations.

scientific article published on 3 August 2007

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Optical spectra of Cu(II)-azurin by hybrid TDDFT-molecular dynamics simulations. (English)

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Michele Cascella

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Ursula Röthlisberger

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Ursula Rothlisberger

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Michel A Cuendet

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Ivano Tavernelli

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3 August 2007

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Journal of Physical Chemistry B

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111

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34

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10248-10252

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10.1021/JP071938I

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17676788

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(Q50943308)

Optical spectra of Cu(II)-azurin by hybrid TDDFT-molecular dynamics simulations.

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