Carregant...

Role of Ligand Reorganization and Conformational Restraints on the Binding Free Energies of DAPY Non-Nucleoside Inhibitors to HIV Reverse Transcriptase

The results of computer simulations of the binding of etravirine (TMC125) and rilpivirine (TMC278) to HIV reverse transcriptase are reported. It is confirmed that consistent binding free energy estimates are obtained with or without the application of torsional restraints when the free energies of i...

Descripció completa

Guardat en:
Dades bibliogràfiques
Autor principal: Gallicchio, Emilio
Format: Artigo
Idioma:Inglês
Publicat: 2012
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3374582/
https://ncbi.nlm.nih.gov/pubmed/22708073
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.4236/cmb.2012.21002
Etiquetes: Afegir etiqueta
Sense etiquetes, Sigues el primer a etiquetar aquest registre!