Feature Selection

Comparison of Ridge Regression, Partial Least-Squares, Pairwise Correlation, Forward- and Best Subset Selection Methods for Prediction of Retention Indices for Aliphatic Alcohols

Orsolya Farkas and Károly Héberger

J. Chem. Inf. Model., 45 (2), 339 -346, 2005. Get Paper

Evaluation of Mutual Information and Genetic Programming for Feature Selection in QSAR

Vishwesh Venkatraman, Andrew Rowland Dalby, and Zheng Rong Yang

J. Chem. Inf. Comput. Sci., 44 (5), 1686 -1692, 2004. Get Paper

A Comparative Study on Feature Selection Methods for Drug Discovery

Ying Liu

J. Chem. Inf. Comput. Sci., 44 (5), 1823 -1828, 2004. Get Paper

Feature Selection for Descriptor Based Classification Models. 1. Theory and GA-SEC Algorithm

Jörg K. Wegner, Holger Fröhlich, and Andreas Zell

J. Chem. Inf. Comput. Sci., 44 (3), 921 -930, 2004. Get Paper

Evaluation of Mutual Information and Genetic Programming for Feature Selection in QSAR

Vishwesh Venkatraman, Andrew Rowland Dalby, and Zheng Rong Yang

J. Chem. Inf. Comput. Sci., 44 (5), 1686 -1692, 2004. Get Paper

An Information-Theoretic Approach to Descriptor Selection for Database Profiling and QSAR Modeling

Jeffrey W. Godden, and Jürgen Bajorath

QSAR Comb. Sci., 22 (5), 487-497, 2003. Get Paper

Selective descriptor pruning for QSAR/QSPR studies using artificial neural networks

Joseph V. Turner , David J. Cutler , Ian Spence , Desmond J. Maddalena

J. Comput. Chem., 24(7), 891-897, 2003. Get Paper