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Water Movement during Ligand Unbinding from Receptor Site

An 1-ns unbinding trajectory of retinol from the bovine serum retinol-binding protein has been obtained from molecular dynamics simulations. The behavior of water during ligand unbinding has never been studied in detail. I described a new method for defining a binding site, located the water molecul...

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Detalles Bibliográficos
Autor Principal: Chau, P.-L.
Formato: Artigo
Idioma:Inglês
Publicado: Biophysical Society 2004
Assuntos:
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC1304335/
https://ncbi.nlm.nih.gov/pubmed/15240451
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.103.036467
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