Toxmatch—A chemical classification and activity prediction tool based on similarity measures

Chemical similarity forms the underlying basis for the development of (Quantitative) Structure–Activity Relationships ((Q)SARs), expert systems and chemical groupings. Recently a new software tool to facilitate chemical similarity calculations named Toxmatch was developed. Toxmatch encodes a number...

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Veröffentlicht in:	Regulatory toxicology and pharmacology 2008-11, Vol.52 (2), p.77-84
Hauptverfasser:	Gallegos-Saliner, Ana, Poater, Albert, Jeliazkova, Nina, Patlewicz, Grace, Worth, Andrew P.
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemical categories Chemical similarity Humans Irritants - chemistry Irritants - classification Irritants - toxicity QSAR Quantitative Structure-Activity Relationship Read across Skin - drug effects Skin Irritancy Tests - methods Skin irritation and corrosion Software Toxicology - methods
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