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Comprehensive and Automated Linear Interaction Energy Based Binding-Affinity Prediction for Multifarious Cytochrome P450 Aromatase Inhibitors.
van Dijk, Marc; Ter Laak, Antonius M; Wichard, Jörg D; Capoferri, Luigi; Vermeulen, Nico P E; Geerke, Daan P.
Afiliação
  • van Dijk M; AIMMS Division of Molecular Toxicology, Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam , De Boelelaan 1108, 1081 HZ Amsterdam, The Netherlands.
  • Ter Laak AM; Bayer AG, Pharmaceuticals Division , Müllerstrasse 178, D-13353 Berlin, Germany.
  • Wichard JD; Bayer AG, Pharmaceuticals Division , Müllerstrasse 178, D-13353 Berlin, Germany.
  • Capoferri L; AIMMS Division of Molecular Toxicology, Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam , De Boelelaan 1108, 1081 HZ Amsterdam, The Netherlands.
  • Vermeulen NPE; AIMMS Division of Molecular Toxicology, Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam , De Boelelaan 1108, 1081 HZ Amsterdam, The Netherlands.
  • Geerke DP; AIMMS Division of Molecular Toxicology, Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam , De Boelelaan 1108, 1081 HZ Amsterdam, The Netherlands.
J Chem Inf Model ; 57(9): 2294-2308, 2017 09 25.
Article em En | MEDLINE | ID: mdl-28776988
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Aromatase / Biologia Computacional / Inibidores da Aromatase Tipo de estudo: Prognostic_studies / Risk_factors_studies Idioma: En Ano de publicação: 2017 Tipo de documento: Article
Texto completo
Imprimir
XML
PubMed Links
Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Aromatase / Biologia Computacional / Inibidores da Aromatase Tipo de estudo: Prognostic_studies / Risk_factors_studies Idioma: En Ano de publicação: 2017 Tipo de documento: Article