Cargando…
An interaction-motif-based scoring function for protein-ligand docking
BACKGROUND: A good scoring function is essential for molecular docking computations. In conventional scoring functions, energy terms modeling pairwise interactions are cumulatively summed, and the best docking solution is selected. Here, we propose to transform protein-ligand interactions into three...
Autores principales: | Xie, Zhong-Ru, Hwang, Ming-Jing |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2010
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3098071/ https://www.ncbi.nlm.nih.gov/pubmed/20525216 http://dx.doi.org/10.1186/1471-2105-11-298 |
Ejemplares similares
-
CoDock-Ligand: combined template-based docking and CNN-based scoring in ligand binding prediction
por: Pang, Mingwei, et al.
Publicado: (2023) -
Development of target-biased scoring functions for protein-ligand docking
por: Scharfe, Michael, et al.
Publicado: (2012) -
LISE: a server using ligand-interacting and site-enriched protein triangles for prediction of ligand-binding sites
por: Xie, Zhong-Ru, et al.
Publicado: (2013) -
AutoDock-GIST: Incorporating Thermodynamics of Active-Site Water into Scoring Function for Accurate Protein-Ligand Docking
por: Uehara, Shota, et al.
Publicado: (2016) -
NPPD: A Protein-Protein Docking Scoring Function Based on Dyadic Differences in Networks of Hydrophobic and Hydrophilic Amino Acid Residues
por: Shih, Edward S. C., et al.
Publicado: (2015)