Saso Dzeroski, Hendrik Blockeel, Boris Kompare, Stefan Kramer, Bernhard Pfahringer, Wim Van Laer  Home/Search
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Abstract: . We present a novel application of inductive logic programming (ILP) in the area of quantitative structure-activity relationships (QSARs). The activity we want to predict is the biodegradability of chemical compounds in water. In particular, the target variable is the half-life in water for aerobic aqueous biodegradation. Structural descriptions of chemicals in terms of atoms and bonds are derived from the chemicals' SMILES encodings. Definition of substructures are used as background... (Update)
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BibTeX entry: (Update)
S. Dzeroski, H. Blockeel, S. Kramer, B. Kompare, B. Pfahringer, and W. Van Laer. Experiments in predicting biodegradability. In S. Dzeroski and P. Flach, editors, Proceedings of the Ninth International Workshop on Inductive Logic Programming, volume 1634 of Lecture Notes in Artificial Intelligence, pages 80--91. Springer-Verlag, 1999. http://citeseer.ist.psu.edu/article/dzeroski99experiments.html More
@inproceedings{ dzeroski99experiments,
author = "Saso Dzeroski and Hendrik Blockeel and Boris Kompare and Stefan Kramer and Bernhard Pfahringer and Wim Van Laer",
title = "Experiments in Predicting Biodegradability",
booktitle = "International Workshop on Inductive Logic Programming",
pages = "80-91",
year = "1999",
url = "citeseer.ist.psu.edu/article/dzeroski99experiments.html" }
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