Brief Records : EPA National Library Catalog

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Document Number: 1 Full Record
Main Title (Q)SARs : evaluation of the commercially available software for human health and environmental endpoints with respect to chemical management applications.
Publisher European Centre for Ecotoxicology and Toxicology of Chemicals,
Year Published 2003
OCLC Number 54089007
Subjects QSAR (Biochemistry) ; Structure-activity relationship ; Computer software ; Toxicity testing--Software
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EJEM  RA1211 .E32 no.89 2003 OCSPP Chemical Library/Washington,DC 04/14/2015
Collation 1 v. ; 30 cm.

Document Number: 2 Full Record
Main Title 3D QSAR in drug design
Other Authors
Author Title of a Work
Kubinyi, Hugo.
Folkers, Gerd.
Martin, Yvonne Connolly
Publisher Kluwer Academic,
Year Published 1900
OCLC Number 37534008
ISBN 0792347927 (set) 0792347900 (v. 2) 9072199146 (v. 1) 0792347919 (v. 3)
Subjects QSAR (Biochemistry) ; Drugs--Design ; Drug Design
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ELDM  RM301.42.A13 1998 v. 2 CCTE/GLTED Library/Duluth,MN 09/25/1998
Collation v. < 2- > : ill. (some col.) ; 25 cm.

Document Number: 3 Full Record
Main Title An SAB report : evaluation of EPA's research on expert systems to predict the fate and effects of chemicals /
Other Authors
Author Title of a Work
Dickson, Kenneth L.
Huggett, R. J.
Loehr, Raymond Charles.
Huggett, Robert James
CORP Author Environmental Protection Agency, Washington, DC. Science Advisory Board.
Publisher U.S. Environmental Protection Agency, Science Advisory Board,
Year Published 1991
Report Number EPA-SAB-EPEC-92-004
Stock Number PB95-228565
OCLC Number 38549336
Subjects Biochemistry--Research ; Expert systems (Computer science)
Additional Subjects Chemical compounds ; Environment effects ; Predictions ; Expert systems ; Computer programming ; Artificial intelligence ; Chemical properties ; Toxicity ; Chemical reactivity ; Spectroscopic analysis ; Research and development ; Organic compounds ; Tests ; Comparative evaluations ; QSAR expert system ; SPARC expert system ; CRAMS expert system ; QSAR(Quantitative Structure Activity Relationships)
Internet Access
Description Access URL
https://nepis.epa.gov/Exe/ZyPDF.cgi?Dockey=94008YEP.PDF
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ELBD ARCHIVE EPA SAB-EPEC-92-004 AWBERC Library/Cincinnati,OH 12/06/2022
NTIS  PB95-228565 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation iv, 11,3 pages ; 28 cm

Document Number: 4 Full Record
Main Title ASTER: An Integration of the ACQUIRE Data Base and the QSAR System for Use in Ecological Risk Assessments.
Author Russom, C. L. ; Anderson, E. B. ; Greenwood, B. E. ; Pilli, A. ;
CORP Author Environmental Research Lab.-Duluth, MN. ;Computer Sciences Corp., Duluth, MN.
Publisher c1991
Year Published 1991
Report Number EPA/600/A-92/141;
Stock Number PB92-198217
Additional Subjects Risk assessment ; Aquatic ecosystems ; Hazardous materials ; Pollution regulations ; Water pollution effects ; US EPA ; Aquatic animals ; Aquatic plants ; Chemical compounds ; Toxicity ; Data storage and retrieval ; Physicochemical properties ; Exposure ; Reprints ; ASsessment Tools for the Evaluation of Risk system ; ASTER computer program ; AQUatic toxicity Information REtrieval system ; Quantitative Structure Activity Relationships systems ; AQUIRE data base ; QSAR system
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NTIS  PB92-198217 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 6p

Document Number: 5 Full Record
Main Title Burger's Medicinal chemistry /
Author Burger, Alfred
Other Authors
Author Title of a Work
Wolff, Manfred E.
Publisher Wiley,
Year Published 1980
OCLC Number 04495896
ISBN 0471015717; 9780471015710; 0471015709; 9780471015703; 0471015725; 9780471015727
Subjects Pharmaceutical chemistry ; Chemistry, Pharmaceutical ; Medische chemie ; Farmacotherapie ; Chemotherapie ; Toxicologie ; QSAR ; Quimica Farmaceutica ; Chimie clinique
Additional Subjects Chemistry, Pharmaceutical
Internet Access
Description Access URL
Contributor biographical information http://catdir.loc.gov/catdir/enhancements/fy0607/78010791-b.html
Publisher description http://catdir.loc.gov/catdir/enhancements/fy0607/78010791-d.html
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EKBM  RS403.B8 1979 v.1 only Research Triangle Park Library/RTP, NC 01/01/1988
Edition 4th ed. /
Collation 3 volumes : illustrations ; 26 cm.

Document Number: 6 Full Record
Main Title Comparative Molecular Field Analysis of Polyhalogenated Dibenzo-p-dioxins, Dibenzofurans, and Biphenyls.
Author Waller, C. L. ; McKinney, J. D. ;
CORP Author Health Effects Research Lab., Research Triangle Park, NC. Environmental Toxicology Div. ;North Carolina Univ. at Chapel Hill. School of Pharmacy.
Publisher cOct 92
Year Published 1992
Report Number EPA/600/J-94/334;
Stock Number PB94-202108
Additional Subjects Toxicity ; Chlorinated aromatic hydrocarbons ; Risk assessment ; Pharmacokinetics ; In vitro analysis ; Molecular structure ; Predictions ; Stereochemistry ; Aryl hydrocarbon receptors ; Enzymes ; Furans ; Dioxin ; Biphenyl ; Models ; Reprints ; QSAR(Quantitative Structure-Activity Relationship) ; Quantitative Structure-Activity Relationship ; PBPK(Physiologically-based pharmacokinetics) ; TCDD(2-3-7-8-Tetrachlorodibenzo-p-dioxin)
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NTIS  PB94-202108 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 10p

Document Number: 7 Full Record
Main Title Computational toxicology : risk assessment for pharmaceutical and environmental chemicals /
Other Authors
Author Title of a Work
Ekins, Sean.
Publisher Wiley-Interscience,
Year Published 2007
OCLC Number 76937381
ISBN 9780470049624 (cloth); 0470049626 (cloth)
Subjects Toxicology--Mathematical models ; Toxicology--Computer simulation ; QSAR (Biochemistry) ; Toxicology--methods ; Computer Simulation ; Drug Toxicity ; Environmental Pollutants--toxicity ; Risk Assessment
Internet Access
Description Access URL
http://www.loc.gov/catdir/enhancements/fy0739/2006100242-b.html
http://www.loc.gov/catdir/enhancements/fy0739/2006100242-d.html
Contributor biographical information http://catdir.loc.gov/catdir/enhancements/fy0739/2006100242-b.html
Publisher description http://catdir.loc.gov/catdir/enhancements/fy0739/2006100242-d.html
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ELDM  RA1199.4.M37C66 2007 CCTE/GLTED Library/Duluth,MN 01/04/2010
Collation xxii, 814 p. : ill. (some col.) ; 25 cm.

Document Number: 8 Full Record
Main Title Electronic Factor in QSAR: MO-Parameters, Competing Interactions, Reactivity and Toxicity.
Author Mekenyan, O. G. ; Veith, G. D. ;
CORP Author Environmental Research Lab.-Duluth, MN. ;Burgas Univ. of Technology (Bulgaria). Dept. of Physical Chemistry.
Publisher c1994
Year Published 1994
Report Number EPA/600/J-94/362;
Stock Number PB94-209681
Additional Subjects Structure-activity relationships ; Toxicity ; Electrons ; Chemical reactivity ; Energy ; Theoretical models ; Reprints ; QSAR(Quantitative structure-activity relationships) ; Quantitative structure-activity relationships
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NTIS  PB94-209681 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 18p

Document Number: 9 Full Record
Main Title Endocrine disruption modeling /
Other Authors
Author Title of a Work
Devillers, J.
Publisher CRC Press,
Year Published 2009
OCLC Number 276648648
ISBN 9781420076356 (hardcover : alk. paper); 1420076353 (hardcover : alk. paper)
Subjects Endocrine disrupting chemicals--Research--Methodology ; QSAR (Biochemistry) ; Endocrine Disruptors ; Quantitative Structure-Activity Relationship
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EKBM  RA1224.2.E625 2009 Research Triangle Park Library/RTP, NC 04/20/2010
Collation 404 p., [7] p. of plates : ill. (some col.) ; 25 cm.

Document Number: 10 Full Record
Main Title Environmental toxicology and chemistry /
Author Crosby, Donald G.
Publisher Oxford University Press,
Year Published 1998
OCLC Number 37180844
ISBN 0195117131 (cloth); 9780195117134 (cloth)
Subjects Environmental toxicology ; Environmental chemistry ; Environmental Pollutants--toxicity ; Chemistry ; Toxicology ; Gevaarlijke stoffen ; Milieutoxicologie ; Risicoanalyse ; Epidemiologie ; Ozonosfeer ; Chlorering ; QSAR ; Carcinogenese ; Toxicologie ; Chimie de l'environnement ; Ecotoxicologie
Internet Access
Description Access URL
Publisher description http://catdir.loc.gov/catdir/enhancements/fy0604/97022438-d.html
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EMBM  RA1226.C76 1998 NRMRL/GWERD Library/Ada,OK 01/02/2004
Collation xiv, 336 p. : ill. ; 25 cm.

Document Number: 11 Full Record
Main Title Existing chemicals evaluating the use of QSAR for estimating biological effects : mutagenicity of hydrazines /
Author Lagersted, Ada.
Publisher Nordic Council of Ministers,
Year Published 1989
OCLC Number 25097814
ISBN 8773033618 (Denmark) 9179961835 (Sweden)
Subjects Hydrazines--Physiological effect ; Mutagenicity--Statistical methods ; QSAR (Chemistry)
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EJEM  RA1242.H88L35 1989 OCSPP Chemical Library/Washington,DC 01/24/1992
Collation 159 p.

Document Number: 12 Full Record
Main Title Exploring QSAR.
Other Authors
Author Title of a Work
Hansch, Corwin.
Leo, Albert.
Hoekman, D. H.
Publisher American Chemical Society,
Year Published 1995
OCLC Number 33407741
ISBN 0841229872 (v. 1); 9780841229877 (v. 1); 0841229880 (v. 1 : pbk.); 9780841229884 (v. 1 : pbk.); 0841229910 (v. 2); 9780841229914 (v. 2); 0841229929 (v. 2 : pbk.); 9780841229921 (v. 2 : pbk.); 0841229937 (set); 9780841229938 (set); 0841230609 (set : pbk.); 9780841230606 (set : pbk.)
Subjects QSAR (Biochemistry) ; Bioquimica ; QSAR ; Relations structure-activite ; Composes organiques--Tables
Internet Access
Description Access URL
Publisher description http://catdir.loc.gov/catdir/enhancements/fy0605/94023811-d.html
Publisher description http://www.loc.gov/catdir/enhancements/fy0605/94023811-d.html
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ELDM  QP517.S85S97 1995 CCTE/GLTED Library/Duluth,MN 08/10/2001
EMBR  QP517.S85S97 1995 V.2 NRMRL/GWERD Library/Ada,OK 02/15/1997
Collation 2 v. : ill. ; 29 cm.

Document Number: 13 Full Record
Main Title Predicting chemical toxicity and fate /
Other Authors
Author Title of a Work
Cronin, Mark T. D.
Livingstone, D.
Publisher CRC Press,
Year Published 2004
OCLC Number 54073110
ISBN 0415271800; 9780415271806; 0415271819; 9780415271813
Subjects Molecular toxicology ; Toxicological chemistry ; QSAR (Biochemistry) ; Toxicologia ; Toxicologia (metodos) ; Ecotoxicologie ; Toxicologie molculaire ; Chimie toxicologique ; Impact environnemental ; Impact sur la sante ; Produit chimique ; Relations quantitatives structure-activite (Biochimie) ; Toxicity ; Chemicals ; Pharmacologic Actions--toxicity ; Environmental Pollutants--toxicity ; Quantitative Structure-Activity Relationship ; Toxicology--methods ; Chemical Actions--toxicity ; Toxicologie moleculaire ; Impact sur la sante ; Relations quantitatives structure-activite (Biochimie) ; Toxicologia (metodos)
Internet Access
Description Access URL
Publisher description http://catdir.loc.gov/catdir/enhancements/fy0646/2004043999-d.html
http://marc.crcnetbase.com/ISBN/9780203642627
CRCnetBASE http://www.crcnetbase.com/isbn/9780203642627
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EJEM  RA1220.3.P74 2004 OCSPP Chemical Library/Washington,DC 09/09/2005
EKBM  RA1220.3.P74 2004 Research Triangle Park Library/RTP, NC 05/19/2006
EKCM  RA1220.3.P74 2004 CEMM/GEMMD Library/Gulf Breeze,FL 05/21/2019
EKDM  RA1220.3.P74 2004 CEMM/EPD Library/Athens,GA 10/29/2012 STATUS
ERAM  RA1220.3.P74 2004 Region 9 Library/San Francisco,CA 07/21/2014
Collation 445 pages : illustrations ; 26 cm

Document Number: 14 Full Record
Main Title Predicting Modes of Toxic Action from Chemical Structure: An Overview.
Author Bradbury, S. P. ;
CORP Author Environmental Research Lab.-Duluth, MN.
Publisher 1994
Year Published 1994
Report Number EPA/600/J-94/258;
Stock Number PB94-176195
Additional Subjects Toxicity ; Fishes ; Water pollution effects(Animals) ; Aquatic animals ; Dose-response relationships ; Marine biology ; Hazardous materials ; Exposure ; Chemical properties ; Biological effects ; Predictions ; Molecular structure ; Mutagens ; Carcinogens ; Reprints ; QSAR(Quantitative structure activity relationships)
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NTIS  PB94-176195 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 18p

Document Number: 15 Full Record
Main Title QSAR Approach for Estimating the Aquatic Toxicity of Soft Electrophiles (QSAR for Soft Electrophiles).
Author Veith, G. D. ; Mekenyan., O. G. ;
CORP Author Environmental Research Lab.-Duluth, MN. ;Wisconsin Univ.-Superior. Lake Superior Research Inst.
Publisher c1993
Year Published 1993
Report Number EPA/600/J-94/178;
Stock Number PB94-163573
Additional Subjects Water pollution effects(Animals) ; Toxicity ; Fishes ; Benzenes ; Phenols ; Anilines ; Narcotics ; Molecular energy levels ; Tables(Data) ; Reprint ; QSAR(Quantitative Structure-Activity Relationship) ; Soft nucleophiles ; Soft electrophiles
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NTIS  PB94-163573 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 10p

Document Number: 16 Full Record
Main Title QSAR in environmental toxicology : proceedings of the Workshop on Quantitative Structure-Activity Relationships (QSAR) in Environmental Toxicology, held at McMaster University, Hamilton, Ontario, Canada, August 16/18, 1983 /
Author Kaiser, Klaus L. E.
Other Authors
Author Title of a Work
Kaiser, Klaus L. E.,
Publisher D. Reidel ; Sold and distributed in the U.S.A. and Canada by Kluwer Academic Publishers,
Year Published 1984
OCLC Number 10777417
ISBN 9027717761; 9789027717764
Subjects Pollutants--Structure-activity relationships--Congresses ; Environmental toxicology--Congresses ; QSAR (Biochemistry)--Congresses ; Environmental Pollutants--toxicity--Congresses ; Structure-Activity Relationship--Congresses
Additional Subjects Pollutants--Structure-activity relationships--Congresses ; Pollutants--Toxicology--Congresses
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ELBM  QH545.A1W67 1983 AWBERC Library/Cincinnati,OH 01/28/1989
ELDM  QH545.A1W67 1983 CCTE/GLTED Library/Duluth,MN 11/18/2013
Collation xiv, 406 p. : ill. ; 25 cm.

Document Number: 17 Full Record
Main Title QSAR system user manual : a structure-activity based chemical modeling and information system /
Author Hunter, Robert S.
Other Authors
Author Title of a Work
Culver, Franklin D.
Publisher Institute for Biological and Chemical Process Analysis, Montana State University,
Year Published 1988
OCLC Number 37382252
Subjects QSAR (Biochemistry)--Computer programs
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EJED  EPA 905/1988.1 OCSPP Chemical Library/Washington,DC 09/10/1999
Collation 1 v. (various pagings) ; 29 cm.

Document Number: 18 Full Record
Main Title QSAR/VFAR Workshop, Summary Report.
Author Siddhanti, S. ; Baier-Anderson, C. ;
CORP Author EnDyna, Inc., McLean, VA. ;Science Applications International Corp., Reston, VA.;Environmental Protection Agency, Cincinnati, OH. National Homeland Security Research Center.
Publisher Aug 2007
Year Published 2007
Report Number EPA/600/R-07/095;
Stock Number PB2008-101566
Additional Subjects Workshop ; QSAR ; VFAR ; Applications ; Chemicals ; Microbes ; Quantitative Structure-Activity Relationship (QSAR)
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NTIS  PB2008-101566 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 100p

Document Number: 19 Full Record
Main Title QSARs for Photoinduced Toxicity: 1. Acute Lethality of Polycyclic Aromatic Hydrocarbons to 'Daphnia magna'.
Author Mekenyan, O. G. ; Ankley, G. T. ; Veith, G. D. ; Call, D. J. ;
CORP Author Environmental Research Lab.-Duluth, MN. ;Wisconsin Univ.-Superior. Lake Superior Research Inst. ;Higher Inst. of Chemical Technology, Burgas (Bulgaria).
Publisher c1994
Year Published 1994
Report Number EPA/600/J-94/253;
Stock Number PB94-176203
Additional Subjects Photochemical reactions ; Toxicity ; Polycyclic aromatic hydrocarbons ; Daphnia ; Molecular structure ; Physicochemical properties ; Statistical analysis ; Models ; Exposure ; Aquatic animals ; Aquatic ecosystems ; Ground state ; Indexes(Ratio) ; Dosage ; Lethality ; Electromagnetic absorption ; Hydrocarbons ; Reprints ; HOMO-LUMO(Highest Occupied Molecular Orbital-Lowest Unoccupied Molecular Orbital) ; Daphnia magna ; QSAR(Quantitative Structure Activity Relationships)
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NTIS  PB94-176203 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 18p

Document Number: 20 Full Record
Main Title QSARs in the assessment of the environmental fate and effects of chemicals /
Other Authors
Author Title of a Work
Carpanini, F. M.
Publisher ECETOC,
Year Published 1998
Report Number ECETOC/TR-74
OCLC Number 41541667
Subjects QSAR (Biochemistry) ; Structure-activity relationship ; Environmental chemistry ; Environmental toxicology ; Milieueffecten ; Risicoanalyse ; Gevaarlijke stoffen
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ELBD ARCHIVE ECETOC/TR-74 Received from HQ AWBERC Library/Cincinnati,OH 10/04/2023
ELBM  QP517.S85Q83 1998 AWBERC Library/Cincinnati,OH 06/11/2021
Collation 136 pages : illustrations ; 30 cm.

Document Number: 21 Full Record
Main Title Quantitative structure-activity relationships for pollution prevention, toxicity screening, risk assessment, and Web applications /
Other Authors
Author Title of a Work
Walker, John D.
Publisher SETAC Press,
Year Published 2003
OCLC Number 53231312
ISBN 1880611368 (alk. paper); 9781880611364 (alk. paper)
Subjects Pollution ; Pollution prevention ; Toxicity testing ; QSAR (Biochemistry)
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EKCM  TD177.Q36 2003 CEMM/GEMMD Library/Gulf Breeze,FL 08/13/2004
EKDM  TD177.Q36 2003 CEMM/EPD Library/Athens,GA 12/26/2012 STATUS
Collation xix, 259 p. : ill. ; 23 cm.

Document Number: 22 Full Record
Main Title Quantitative structure-activity relationships in environmental sciences, VII /
Other Authors
Author Title of a Work
Chen, Fei,
Scheueurmann, Gerrit.
Sch u urmann, Gerrit.
Publisher SETAC Press,
Year Published 1997
OCLC Number 37437543
ISBN 1880611236 (alk. paper); 9781880611234 (alk. paper)
Subjects Environmental toxicology--Methodology--Congresses ; Environmental chemistry--Methodology--Congresses ; QSAR (Biochemistry)--Congresses
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EKCM  RA1226.Q73 1997 CEMM/GEMMD Library/Gulf Breeze,FL 12/04/1998
ELDM  RA1226.Q73 1997 CCTE/GLTED Library/Duluth,MN 10/06/2006
Collation xxiv, 470 p. : ill. ; 24 cm.

Document Number: 23 Full Record
Main Title Quantitative structure-activity relationships including molecular modelling and applications of computer graphics in pharmacology, chemistry, and biology : QSAR.
Publisher VCH Verlagsgesellschaft mbH,
Year Published 1985
OCLC Number 14268674
ISSN 0931-8771
Subjects Drugs--Structure-activity relationships--Periodicals ; Xenobiotics--Structure-activity relationships--Periodicals ; QSAR (Biochemistry)--Periodicals ; Biology--Periodicals ; Computer graphics--Periodicals ; Models, Molecular ; Pharmacology ; Structuur-activiteit-relatie ; Models, Molecular--periodicals ; Pharmacology--periodicals ; Structure-Activity Relationship--abstracts ; Structure-Activity Relationship--periodicals
Internet Access
Description Access URL
http://www.interscience.wiley.com/jpages/0931-8771/
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EJEJ  JOURNALS v.5 1986 - v.6 1987, v.8 1989 - v.11 1992 OCSPP Chemical Library/Washington,DC 01/27/2016
ELDJ  JOURNALS v.4:4 1985 - v.14:6 1995 CCTE/GLTED Library/Duluth,MN 02/21/2017
Collation 18 volumes : illustrations ; 30 cm

Document Number: 24 Full Record
Main Title Recent advances in QSAR studies : methods and applications /
Other Authors
Author Title of a Work
Puzyn, Tomasz.
Leszczynski, Jerzy,
Publisher Springer,
Year Published 2010
OCLC Number 501802796
ISBN 9781402097829 (geb.); 1402097824 (geb.); 9781402097836 (e-book); 1402097832 (e-book)
Subjects QSAR (Biochemistry)
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EKCM  RA1226.Q73 2010 CEMM/GEMMD Library/Gulf Breeze,FL 04/13/2011
Collation XIV, 423 p. : ill. ; 25 cm.

Document Number: 25 Full Record
Main Title Risks of Toxic Contaminants to Exploited Fish Populations: Influence of Life History, Data Uncertainty and Exploitation Intensity.
Author Barnthouse, L. W. ; Suter, G. W. ; Rosen., A. E. ;
CORP Author Oak Ridge National Lab., TN. Environmental Sciences Div. ;Martin Marietta Energy Systems, Inc., Oak Ridge, TN.;Department of Energy, Washington, DC.;Environmental Research Lab., Gulf Breeze, FL.
Publisher c1990
Year Published 1990
Report Number ORNL/PUB-3336; DE-AC05-84OR21400; EPA/600/J-90/513;
Stock Number PB91-199984
Additional Subjects Toxic substances ; Water pollution effects(Animals) ; Marine fishes ; Stress ; Risk assessment ; Life cycles ; Dose-response relationships ; Bass ; Reprints ; Menhaden ; Quantitative structure-activity relationship(QSAR) ; Brevoortia patronus ; Morone saxatilis
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NTIS  PB91-199984 Some EPA libraries have a fiche copy filed under the call number shown. 07/26/2022
Collation 17p

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