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ICML
2007
IEEE
16 years 7 months ago
An integrated approach to feature invention and model construction for drug activity prediction
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...
David Page, Jesse Davis, Soumya Ray, Vítor ...
ICML
2007
IEEE
16 years 7 months ago
Combining online and offline knowledge in UCT
The UCT algorithm learns a value function online using sample-based search. The TD() algorithm can learn a value function offline for the on-policy distribution. We consider three...
Sylvain Gelly, David Silver
159
Voted
ICML
2007
IEEE
16 years 7 months ago
Relational clustering by symmetric convex coding
Relational data appear frequently in many machine learning applications. Relational data consist of the pairwise relations (similarities or dissimilarities) between each pair of i...
Bo Long, Zhongfei (Mark) Zhang, Xiaoyun Wu, Philip...
277
Voted
ICML
2007
IEEE
16 years 7 months ago
Discriminant analysis in correlation similarity measure space
Correlation is one of the most widely used similarity measures in machine learning like Euclidean and Mahalanobis distances. However, compared with proposed numerous discriminant ...
Yong Ma, Shihong Lao, Erina Takikawa, Masato Kawad...
ICML
2007
IEEE
16 years 7 months ago
Graph clustering with network structure indices
Graph clustering has become ubiquitous in the study of relational data sets. We examine two simple algorithms: a new graphical adaptation of the k-medoids algorithm and the Girvan...
Matthew J. Rattigan, Marc Maier, David Jensen
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