Genetic Programming in Data Mining for Drug Discovery
Created by W.Langdon from
gp-bibliography.bib Revision:1.8120
- @InCollection{langdon:2004:ECDM,
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author = "W. B. Langdon and S. J. Barrett",
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title = "Genetic Programming in Data Mining for Drug
Discovery",
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booktitle = "Evolutionary Computing in Data Mining",
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publisher = "Springer",
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year = "2004",
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editor = "Ashish Ghosh and Lakhmi C. Jain",
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volume = "163",
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series = "Studies in Fuzziness and Soft Computing",
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chapter = "10",
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pages = "211--235",
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keywords = "genetic algorithms, genetic programming, drug
discovery, ROC fitness, ADMET",
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ISBN = "3-540-22370-3",
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URL = "http://www.cs.ucl.ac.uk/staff/W.Langdon/ftp/papers/wbl_bioavail.pdf",
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URL = "http://www.cs.ucl.ac.uk/staff/W.Langdon/ftp/papers/wbl_bioavail.ps.gz",
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URL = "http://www.springeronline.com/sgw/cda/frontpage/0,11855,5-175-22-33980376-0,00.html",
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abstract = "Genetic programming (GP) is used to extract from rat
oral bioavailability (OB) measurements simple,
interpretable and predictive QSAR models which both
generalise to rats and to marketed drugs in humans.
Receiver Operating Characteristics (ROC) curves for the
binary classifier produced by machine learning show no
statistical difference between rats (albeit without
known clearance differences) and man. Thus evolutionary
computing offers the prospect of in silico ADME
screening e.g. for virtual chemicals, for
pharmaceutical drug discovery.",
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notes = "wbl_bioavail postscript and PDF page numbering and
figures NOT identical to published book",
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size = "25 pages",
- }
Genetic Programming entries for
William B Langdon
S J Barrett
Citations