Literature DB >> 12924572

Recent developments in broadly applicable structure-biodegradability relationships.

Joanna S Jaworska1, Robert S Boethling, Philip H Howard.   

Abstract

Biodegradation is one of the most important processes influencing concentration of a chemical substance after its release to the environment. It is the main process for removal of many chemicals from the environment and therefore is an important factor in risk assessments. This article reviews available methods and models for predicting biodegradability of organic chemicals from structure. The first section of the article briefly discusses current needs for biodegradability estimation methods related to new and existing chemicals and in the context of multimedia exposure models. Following sections include biodegradation test methods and endpoints used in modeling, with special attention given to the Japanese Ministry of International Trade and Industry test; a primer on modeling, describing the various approaches that have been used in the structure/biodegradability relationship work, and contrasting statistical and mechanistic approaches; and recent developments in structure/biodegradability relationships, divided into group contribution, chemometric, and artificial intelligence approaches.

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Year:  2003        PMID: 12924572     DOI: 10.1897/01-302

Source DB:  PubMed          Journal:  Environ Toxicol Chem        ISSN: 0730-7268            Impact factor:   3.742


  4 in total

Review 1.  Evaluation of artificial intelligence based models for chemical biodegradability prediction.

Authors:  James R Baker; Dragan Gamberger; James R Mihelcic; Aleksandar Sabljić
Journal:  Molecules       Date:  2004-12-31       Impact factor: 4.411

2.  Prediction of the Fate of Organic Compounds in the Environment From Their Molecular Properties: A Review.

Authors:  Laure Mamy; Dominique Patureau; Enrique Barriuso; Carole Bedos; Fabienne Bessac; Xavier Louchart; Fabrice Martin-Laurent; Cecile Miege; Pierre Benoit
Journal:  Crit Rev Environ Sci Technol       Date:  2015-06-18       Impact factor: 12.561

3.  Modeling the Biodegradability of Chemical Compounds Using the Online CHEmical Modeling Environment (OCHEM).

Authors:  Susann Vorberg; Igor V Tetko
Journal:  Mol Inform       Date:  2013-11-28       Impact factor: 3.353

4.  Comprehensive micropollutant screening using LC-HRMS/MS at three riverbank filtration sites to assess natural attenuation and potential implications for human health.

Authors:  Juliane Hollender; Judith Rothardt; Dirk Radny; Martin Loos; Jannis Epting; Peter Huggenberger; Paul Borer; Heinz Singer
Journal:  Water Res X       Date:  2018-11-02
  4 in total

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