Cargando…

Estimation of the protein–ligand interaction energy for model building and validation

Macromolecular X-ray crystallography is one of the main experimental techniques to visualize protein–ligand interactions. The high complexity of the ligand universe, however, has delayed the development of efficient methods for the automated identification, fitting and validation of ligands in their...

Descripción completa

Detalles Bibliográficos
Autores principales: Beshnova, Daria A., Pereira, Joana, Lamzin, Victor S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5349431/
https://www.ncbi.nlm.nih.gov/pubmed/28291754
http://dx.doi.org/10.1107/S2059798317003400