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Comparison of Grand Canonical and Conventional Molecular Dynamics Simulation Methods for Protein-Bound Water Networks.
Ekberg, Vilhelm; Samways, Marley L; Misini Ignjatovic, Majda; Essex, Jonathan W; Ryde, Ulf.
Afiliação
  • Ekberg V; Department of Theoretical Chemistry, Lund University, Chemical Centre, P.O. Box 124, Lund SE-221 00, Sweden.
  • Samways ML; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K.
  • Misini Ignjatovic M; Department of Theoretical Chemistry, Lund University, Chemical Centre, P.O. Box 124, Lund SE-221 00, Sweden.
  • Essex JW; School of Chemistry, University of Southampton, Southampton SO17 1BJ, U.K.
  • Ryde U; Department of Theoretical Chemistry, Lund University, Chemical Centre, P.O. Box 124, Lund SE-221 00, Sweden.
ACS Phys Chem Au ; 2(3): 247-259, 2022 May 25.
Article em En | MEDLINE | ID: mdl-35637786
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Texto completo: 1 Base de dados: MEDLINE Idioma: En Revista: ACS Phys Chem Au Ano de publicação: 2022 Tipo de documento: Article País de afiliação: Suécia
Texto completo
Imprimir
XML
PubMed Links
Buscar no Google

Texto completo: 1 Base de dados: MEDLINE Idioma: En Revista: ACS Phys Chem Au Ano de publicação: 2022 Tipo de documento: Article País de afiliação: Suécia