Advanced search
Publication Cover
SAR and QSAR in Environmental Research Volume 12, 2001 - Issue 6
Submit an article Journal homepage
39
Views
25
CrossRef citations to date
0
Altmetric
Original Articles

Prediction of Mutagenicity Utilizing A Hierarchical Qsar Approach

S. C. Basak Natural Resources Research Institute, University of Minnesota Duluth, 5013 Miller Trunk Highway, Duluth, MN, 55811, USA; Golden Jubilee Symposium “Current Trends in Drug Discovery Research”, Febrary 11-15, 2001, Lucknow, India
&
D. Mills Natural Resources Research Institute, University of Minnesota Duluth, 5013 Miller Trunk Highway, Duluth, MN, 55811, USA
Pages 481-496 | Received 19 Feb 2001, Accepted 10 Jun 2001, Published online: 05 Oct 2006

Citations (25)

Keep up to date with the latest research on this topic with citation updates for this article.

Subscribe to citation updates

Read on this site (6)

J. Devillers & E. Mombelli. (2010) Evaluation of the OECD QSAR Application Toolbox and Toxtree for estimating the mutagenicity of chemicals. Part 1. Aromatic amines. SAR and QSAR in Environmental Research 21:7-8, pages 753-769.
Read now
D.M. Hawkins, J.J. Kraker, S.C. Basak & D. Mills. (2008) QSPR checking and validation: a case study with hydroxy radical reaction rate constant. SAR and QSAR in Environmental Research 19:5-6, pages 525-539.
Read now
S. C. Basak, D. Mills & M. M. Mumtaz. (2007) A quantitative structure–activity relationship (QSAR) study of dermal absorption using theoretical molecular descriptors . SAR and QSAR in Environmental Research 18:1-2, pages 45-55.
Read now
S. C. Basak, D. Mills & B. D. Gute. (2006) Prediction of tissue: air partition coefficients — theoretical . experimental methods. SAR and QSAR in Environmental Research 17:5, pages 515-532.
Read now
S. C. Basak, R. Natarajan, D. Mills, D. M. Hawkins & J. J. Kraker. (2005) Quantitative structure-activity relationship modeling of insect juvenile hormone activity of 2,4-dienoates using computed molecular descriptors. SAR and QSAR in Environmental Research 16:6, pages 581-606.
Read now
S.C. Basak, D. Mills, D.M. Hawkins & H.A. El-Masri. (2002) Prediction of tissue-air partition coefficients: A comparison of structure-based and property-based methods. SAR and QSAR in Environmental Research 13:7-8, pages 649-665.
Read now

Articles from other publishers (19)

Alexander Tropsha, Alexander Golbraikh & Won-Jea Cho. (2011) Development of kNN QSAR Models for 3-Arylisoquinoline Antitumor Agents. Bulletin of the Korean Chemical Society 32:7, pages 2397-2404.
Crossref
Roberto Todeschini & Viviana Consonni. 2009. Molecular Descriptors for Chemoinformatics. Molecular Descriptors for Chemoinformatics 1 241 .
Subhash C. Basak, Denise Mills, Douglas M. Hawkins & Jessica J. Kraker. (2009) Quantitative Structure–Activity Relationship (QSAR) Modeling of Human Blood : Air Partitioning with Proper Statistical Methods and Validation. Chemistry & Biodiversity 6:4, pages 487-502.
Crossref
Subhash Basak, Denise Mills, Ramanathan Natarajan & Brian Gute. 2009. Chemical Reactivity Theory. Chemical Reactivity Theory.
Maykel Cruz-MonteagudoHumberto González-DíazFernanda BorgesElena Rosa DominguezM. Natália D.S. Cordeiro. (2008) 3D-MEDNEs: An Alternative “in Silico” Technique for Chemical Research in Toxicology. 2. Quantitative Proteome−Toxicity Relationships (QPTR) based on Mass Spectrum Spiral Entropy. Chemical Research in Toxicology 21:3, pages 619-632.
Crossref
Shuxing Zhang, Alexander Golbraikh & Alexander Tropsha. (2006) Development of Quantitative Structure−Binding Affinity Relationship Models Based on Novel Geometrical Chemical Descriptors of the Protein−Ligand Interfaces. Journal of Medicinal Chemistry 49:9, pages 2713-2724.
Crossref
Subhash Basak, Denise Mills & Brian Gute. 2006. Biological Concepts and Techniques in Toxicology. Biological Concepts and Techniques in Toxicology 61 82 .
Marjan Vračko, Subhash C. Basak, Kevin Geiss & Frank Witzmann. (2005) Proteomic Maps−Toxicity Relationship of Halocarbons Studied with Similarity Index and Genetic Algorithm. Journal of Chemical Information and Modeling 46:1, pages 130-136.
Crossref
Marjan Vračko. 2006. QSAR and Molecular Modeling Studies in Heterocyclic Drugs II. QSAR and Molecular Modeling Studies in Heterocyclic Drugs II 85 106 .
Subhash C. Basak, Denise Mills, Brian D. Gute & Ramanathan Natarajan. 2006. QSAR and Molecular Modeling Studies in Heterocyclic Drugs I. QSAR and Molecular Modeling Studies in Heterocyclic Drugs I 39 80 .
M. Vraćko, A. Szymoszek & P. Barbieri. (2004) Structure-Mutagenicity Study of 12 Trimethylimidazopyridine Isomers Using Orbital Energies and “Spectrum-like Representation” As Descriptors. Journal of Chemical Information and Computer Sciences 44:2, pages 352-358.
Crossref
Marjan Vracko, Denise Mills & Subhash C. Basak. (2004) Structure-mutagenicity modelling using counter propagation neural networks. Environmental Toxicology and Pharmacology 16:1-2, pages 25-36.
Crossref
Subhash C. Basak, Denise Mills, Hisham A El-Masri, Moiz M Mumtaz & Douglas M Hawkins. (2004) Predicting blood:air partition coefficients using theoretical molecular descriptors. Environmental Toxicology and Pharmacology 16:1-2, pages 45-55.
Crossref
Douglas M Hawkins, Subhash C Basak & Denise Mills. (2004) QSARs for chemical mutagens from structure: ridge regression fitting and diagnostics. Environmental Toxicology and Pharmacology 16:1-2, pages 37-44.
Crossref
Subhash C. BasakKrishnan BalasubramanianBrian D. GuteDenise MillsAnna GorczynskaSzczepan Roszak. (2003) Prediction of Cellular Toxicity of Halocarbons from Computed Chemodescriptors:  A Hierarchical QSAR Approach. Journal of Chemical Information and Computer Sciences 43:4, pages 1103-1109.
Crossref
Alexander Tropsha, Paola Gramatica & Vijay K. Gombar. (2003) The Importance of Being Earnest: Validation is the Absolute Essential for Successful Application and Interpretation of QSPR Models. QSAR & Combinatorial Science 22:1, pages 69-77.
Crossref
Denise Mills, Douglas Hawkins, Brian Gute & Subhash Basak. 2003. Quantitative Structure-Activity Relationship (QSAR) Models of Mutagens and Carcinogens. Quantitative Structure-Activity Relationship (QSAR) Models of Mutagens and Carcinogens.
Marjana Novic & Marjan Vracko. 2003. Nature-insprired Methods in Chemometrics: Genetic Algorithms and Artificial Neural Networks. Nature-insprired Methods in Chemometrics: Genetic Algorithms and Artificial Neural Networks 231 256 .
Subhash C. Basak, Denise Mills, Brian D. Gute, Gregory D. Grunwald & Alexandru T. Balaban. 2002. Topology in Chemistry. Topology in Chemistry 113 184 .

Reprints and Corporate Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

To request a reprint or corporate permissions for this article, please click on the relevant link below:

Order Reprints Request Corporate Permissions

Academic Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

Obtain permissions instantly via Rightslink by clicking on the button below:

Request Academic Permissions

If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.

Related research

People also read lists articles that other readers of this article have read.

Recommended articles lists articles that we recommend and is powered by our AI driven recommendation engine.

Cited by lists all citing articles based on Crossref citations.
Articles with the Crossref icon will open in a new tab.