Carregant...

Improved Ligand-Protein Binding Affinity Predictions Using Multiple Binding Modes

Accurate ligand-protein binding affinity prediction, for a set of similar binders, is a major challenge in the lead optimization stage in drug development. In general, docking and scoring functions perform unsatisfactorily in this application. Docking calculations, followed by molecular dynamics sim...

Descripció completa

Guardat en:
Dades bibliogràfiques
Autors principals: Stjernschantz, Eva, Oostenbrink, Chris
Format: Artigo
Idioma:Inglês
Publicat: The Biophysical Society 2010
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2877349/
https://ncbi.nlm.nih.gov/pubmed/20513413
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2010.02.034
Etiquetes: Afegir etiqueta
Sense etiquetes, Sigues el primer a etiquetar aquest registre!