Limitations of non-polarizable force fields in describing anion binding poses in non-polar synthetic hosts.

Seiferth, David; Tucker, Stephen J; Biggin, Philip C

Seiferth, David; Tucker, Stephen J; Biggin, Philip C.

Afiliación

Seiferth D; Clarendon Laboratory, Department of Physics, University of Oxford, Oxford, OX1 3PU, UK.
Tucker SJ; Structural Bioinformatics and Computational Biochemistry, Department of Biochemistry, University of Oxford, Oxford, OX1 3QU, UK. philip.biggin@bioch.ox.ac.uk.
Biggin PC; Clarendon Laboratory, Department of Physics, University of Oxford, Oxford, OX1 3PU, UK.

Phys Chem Chem Phys ; 25(26): 17596-17608, 2023 Jul 05.

Article en En | MEDLINE | ID: mdl-37365974

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Texto completo: 1 Colección: 01-internacional Banco de datos: MEDLINE Idioma: En Revista: Phys Chem Chem Phys Asunto de la revista: BIOFISICA / QUIMICA Año: 2023 Tipo del documento: Article País de afiliación: Reino Unido

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