Enhance the performance of current scoring functions with the aid of 3D protein-ligand interaction fingerprints

BACKGROUND: In structure-based drug design, binding affinity prediction remains as a challenging goal for current scoring functions. Development of target-biased scoring functions provides a new possibility for tackling this problem, but this approach is also associated with certain technical diffic...

Descripción completa

Detalles Bibliográficos
Autores principales: Liu, Jie, Su, Minyi, Liu, Zhihai, Li, Jie, Li, Yan, Wang, Renxiao
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2017
Materias:
Methodology Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5516336/
https://www.ncbi.nlm.nih.gov/pubmed/28720122
http://dx.doi.org/10.1186/s12859-017-1750-5

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5516336/
https://www.ncbi.nlm.nih.gov/pubmed/28720122
http://dx.doi.org/10.1186/s12859-017-1750-5

Ejemplares similares