(Q57132944)

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QM/MM calculations with DFT for taking into account protein effects on the EPR and optical spectra of metalloproteins. Plastocyanin as a case study

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title

QM/MM calculations with DFT for taking into account protein effects on the EPR and optical spectra of metalloproteins. Plastocyanin as a case study (English)

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Frank Neese

2

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author name string

Sebastian Sinnecker

series ordinal

1

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language of work or name

English

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publication date

September 2006

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published in

Journal of Computational Chemistry

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volume

27

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issue

12

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page(s)

1463-75

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cites work

RI-MP2: first derivatives and global consistency

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https://api.crossref.org/works/10.1002%2FJCC.20426

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21 January 2018

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DOI

10.1002/JCC.20426

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journals/jcc/SinneckerN06

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DBLP Dataset 2021-01-02

retrieved

28 January 2021

PubMed publication ID

16807973

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(Q57132944)

QM/MM calculations with DFT for taking into account protein effects on the EPR and optical spectra of metalloproteins. Plastocyanin as a case study

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