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    BMCBI
    2008
    172views more  BMCBI 2008»
    Classification of drug molecules considering their IC50 values using mixed-integer linear programming based hyper-boxes method
    13 years 11 months ago
    Classification of drug molecules considering their IC50 values using mixed-integer linear programming based hyper-boxes method
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    Background: A priori analysis of the activity of drugs on the target protein by computational approaches can be useful in narrowing down drug candidates for further experimental t...
    Pelin Armutlu, Muhittin Emre Ozdemir, Fadime Ü...
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    IMSCCS
    2007
    IEEE
    150views Theoretical Computer Science» more  IMSCCS 2007»
    Asymmetric Bagging and Feature Selection for Activities Prediction of Drug Molecules
    14 years 5 months ago
    Asymmetric Bagging and Feature Selection for Activities Prediction of Drug Molecules
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    Background: Activities of drug molecules can be predicted by QSAR (quantitative structure activity relationship) models, which overcomes the disadvantages of high cost and long cy...
    Guo-Zheng Li, Hao-Hua Meng, Mary Qu Yang, Jack Y. ...
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