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Improving Scoring-Docking-Screening Powers of Protein-Ligand Scoring Functions using Random Forest

The development of new protein-ligand scoring functions using machine learning algorithms, such as random forest, has been of significant interest. By efficiently utilizing expanded feature sets and a large set of experimental data, random forest based scoring functions (RFbScore) can achieve better...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Veröffentlicht in:J Comput Chem
Hauptverfasser: Wang, Cheng, Zhang, Yingkai
Format: Artigo
Sprache:Inglês
Veröffentlicht: 2016
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5140681/
https://ncbi.nlm.nih.gov/pubmed/27859414
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.24667
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