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Pseudocontact shifts and paramagnetic susceptibility in semiempirical and quantum chemistry theories.
Parigi, Giacomo; Benda, Ladislav; Ravera, Enrico; Romanelli, Maurizio; Luchinat, Claudio.
Afiliação
  • Parigi G; Magnetic Resonance Center (CERM) and Interuniversity Consortium for Magnetic Resonance of Metallo Proteins (CIRMMP), Via Luigi Sacconi 6, 50019 Sesto Fiorentino, Italy.
  • Benda L; Centre de RMN à Très Hauts Champs, FRE 2034 CNRS, ENS de Lyon, UCB Lyon 1, 5 Rue de la Doua, 69100 Villeurbanne (Lyon), France.
  • Ravera E; Magnetic Resonance Center (CERM) and Interuniversity Consortium for Magnetic Resonance of Metallo Proteins (CIRMMP), Via Luigi Sacconi 6, 50019 Sesto Fiorentino, Italy.
  • Romanelli M; Department of Earth Sciences, University of Florence, Via Giorgio La Pira 4, 50121 Florence, Italy.
  • Luchinat C; Magnetic Resonance Center (CERM) and Interuniversity Consortium for Magnetic Resonance of Metallo Proteins (CIRMMP), Via Luigi Sacconi 6, 50019 Sesto Fiorentino, Italy.
J Chem Phys ; 150(14): 144101, 2019 Apr 14.
Article em En | MEDLINE | ID: mdl-30981251
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2019 Tipo de documento: Article
Texto completo
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2019 Tipo de documento: Article