Carregant...
Computing the binding affinity of a ligand buried deep inside a protein with the hybrid steered molecular dynamics
Computing the ligand-protein binding affinity (or the Gibbs free energy) with chemical accuracy has long been a challenge for which many methods/approaches have been developed and refined with various successful applications. False positives and, even more harmful, false negatives have been and stil...
Guardat en:
| Publicat a: | Biochem Biophys Res Commun |
|---|---|
| Autors principals: | , , , |
| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
2016
|
| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5253313/ https://ncbi.nlm.nih.gov/pubmed/28034750 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bbrc.2016.12.165 |
| Etiquetes: |
Afegir etiqueta
Sense etiquetes, Sigues el primer a etiquetar aquest registre!
|