3 search results - page 1 / 1 » Asymmetric Bagging and Feature Selection for Activities Pred... |
IMSCCS
2007
IEEE
13 years 11 months ago
2007
IEEE
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...
ICML
2007
IEEE
14 years 5 months ago
2007
IEEE
We present a new machine learning approach for 3D-QSAR, the task of predicting binding affinities of molecules to target proteins based on 3D structure. Our approach predicts bind...
PAMI
2006
13 years 4 months ago
2006
Multiple-instance problems arise from the situations where training class labels are attached to sets of samples (named bags), instead of individual samples within each bag (called...