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Robust optimization of SVM hyperparameters in the classification of bioactive compounds

BACKGROUND: Support Vector Machine has become one of the most popular machine learning tools used in virtual screening campaigns aimed at finding new drug candidates. Although it can be extremely effective in finding new potentially active compounds, its application requires the optimization of the...

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Gorde:
Xehetasun bibliografikoak
Argitaratua izan da:J Cheminform
Egile Nagusiak: Czarnecki, Wojciech M, Podlewska, Sabina, Bojarski, Andrzej J
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: Springer International Publishing 2015
Gaiak:
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC4534515/
https://ncbi.nlm.nih.gov/pubmed/26273325
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-015-0088-0
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