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Substituting random forest for multiple linear regression improves binding affinity prediction of scoring functions: Cyscore as a case study

BACKGROUND: State-of-the-art protein-ligand docking methods are generally limited by the traditionally low accuracy of their scoring functions, which are used to predict binding affinity and thus vital for discriminating between active and inactive compounds. Despite intensive research over the year...

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Autori principali: Li, Hongjian, Leung, Kwong-Sak, Wong, Man-Hon, Ballester, Pedro J
Natura: Artigo
Lingua:Inglês
Pubblicazione: BioMed Central 2014
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC4153907/
https://ncbi.nlm.nih.gov/pubmed/25159129
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1471-2105-15-291
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