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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...

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Main Authors: Xie, Zhong-Ru, Hwang, Ming-Jing
Formáid: Artigo
Teanga:Inglês
Foilsithe: BioMed Central 2010
Ábhair:
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC3098071/
https://ncbi.nlm.nih.gov/pubmed/20525216
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1471-2105-11-298
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