-
1
-
-
0023218916
-
Quantitative structure-activity relationships for the toxicity and bioconcentration factor of nitrobenzene derivatives towards the guppy (Poecilia reticulata)
-
Deneer, J. W., Sinnige, T. L., Seinen, W., and Hermens, J. L. M. (1987) Quantitative structure-activity relationships for the toxicity and bioconcentration factor of nitrobenzene derivatives towards the guppy (Poecilia reticulata). Aquat. Toxicol. 10, 115-129.
-
(1987)
Aquat. Toxicol.
, vol.10
, pp. 115-129
-
-
Deneer, J.W.1
Sinnige, T.L.2
Seinen, W.3
Hermens, J.L.M.4
-
2
-
-
0024364251
-
QSAR study of the toxicity of nitrobenzene derivatives toward Daphnia magna, Chlorella pyrenoidosa, and Photobacterium phosphoreum
-
Deneer, J. W., van Leeuwen, C. J., Seinen, W., Maas-Diepeveen, J. L., and Hermens, J. L. M. (1989) QSAR study of the toxicity of nitrobenzene derivatives toward Daphnia magna, Chlorella pyrenoidosa, and Photobacterium phosphoreum. Aquat. Toxicol. 15, 83-98.
-
(1989)
Aquat. Toxicol.
, vol.15
, pp. 83-98
-
-
Deneer, J.W.1
Van Leeuwen, C.J.2
Seinen, W.3
Maas-Diepeveen, J.L.4
Hermens, J.L.M.5
-
3
-
-
0003005627
-
An analysis of published data on fish toxicity of nitrobenzenes and aniline derivatives
-
Kaiser, K. L. E., Ed., D. Reidel, Dordrecht, The Netherlands
-
Roberts, D. W. (1987) An analysis of published data on fish toxicity of nitrobenzenes and aniline derivatives. In QSAR in Environmental Toxicology - II (Kaiser, K. L. E., Ed.) pp 295-308, D. Reidel, Dordrecht, The Netherlands.
-
(1987)
QSAR in Environmental Toxicology - II
, pp. 295-308
-
-
Roberts, D.W.1
-
4
-
-
0027741310
-
A QSAR approach for estimating the aquatic toxicity of soft electrophiles [QSAR for soft electrophiles]
-
Veith, G. D., and Mekenyan, O. G. (1993) A QSAR approach for estimating the aquatic toxicity of soft electrophiles [QSAR for soft electrophiles]. Quant. Struct.-Act. Relat. 12, 349-356.
-
(1993)
Quant. Struct.-Act. Relat.
, vol.12
, pp. 349-356
-
-
Veith, G.D.1
Mekenyan, O.G.2
-
5
-
-
0029622330
-
QSAR study of the toxicity of nitrobenzenes to Tetrahymena pyriformis
-
Dearden, J. C., Cronin, M. T. D., Schultz, T. W., and Lin, D. T. (1995) QSAR study of the toxicity of nitrobenzenes to Tetrahymena pyriformis. Quant. Struct.-Act. Relat. 14, 427-432.
-
(1995)
Quant. Struct.-Act. Relat.
, vol.14
, pp. 427-432
-
-
Dearden, J.C.1
Cronin, M.T.D.2
Schultz, T.W.3
Lin, D.T.4
-
6
-
-
0029935674
-
QSAR for the acute toxicity of nitroaromatics to the carp (Cyprinus carpio)
-
Lang, P.-Z., Ma, X.-F., Lu, G.-H., Wang, Y., and Bian, Y. (1996) QSAR for the acute toxicity of nitroaromatics to the carp (Cyprinus carpio). Chemosphere 32, 1547-1552.
-
(1996)
Chemosphere
, vol.32
, pp. 1547-1552
-
-
Lang, P.-Z.1
Ma, X.-F.2
Lu, G.-H.3
Wang, Y.4
Bian, Y.5
-
7
-
-
0031474911
-
QSAR study of the toxicity of nitrobenzenes to river bacteria and Photobacterium phosphoreum
-
Yuan, X., Lu, G., and Lang, P. (1997) QSAR study of the toxicity of nitrobenzenes to river bacteria and Photobacterium phosphoreum. Bull. Environ. Contam. Toxicol. 58, 123-127.
-
(1997)
Bull. Environ. Contam. Toxicol.
, vol.58
, pp. 123-127
-
-
Yuan, X.1
Lu, G.2
Lang, P.3
-
8
-
-
0030902946
-
Quantitative structure-activity relationships of nitroaromatic compounds to four aquatic organisms
-
Zhao, Y.-H., Yuan, X. Ji, G-D., Sheng, L. X., and Wang, L.-S. (1997) Quantitative structure-activity relationships of nitroaromatic compounds to four aquatic organisms. Chemosphere 34, 1837-1844.
-
(1997)
Chemosphere
, vol.34
, pp. 1837-1844
-
-
Zhao, Y.-H.1
Yuan, X.2
Ji, G.-D.3
Sheng, L.X.4
Wang, L.-S.5
-
9
-
-
0026087709
-
Structure-activity relationship of mutagenic aromatic and heteroaromatic nitro compounds. Correlation with molecular orbital energies and hydrophobicity
-
Debnath, A. K., de Compadre, R. L. L., Debnath, G., Shusterman, A. J., and Hansch, C. (1991) Structure-activity relationship of mutagenic aromatic and heteroaromatic nitro compounds. Correlation with molecular orbital energies and hydrophobicity. J. Med. Chem. 34, 786-797.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 786-797
-
-
Debnath, A.K.1
De Compadre, R.L.L.2
Debnath, G.3
Shusterman, A.J.4
Hansch, C.5
-
12
-
-
0028949465
-
QSAR in toxicology. 1. Prediction of aquatic toxicity
-
Cronin, M. T. D., and Dearden, J. C. (1995) QSAR in toxicology. 1. Prediction of aquatic toxicity. Quant. Struct.-Act. Relat. 14, 1-7.
-
(1995)
Quant. Struct.-Act. Relat.
, vol.14
, pp. 1-7
-
-
Cronin, M.T.D.1
Dearden, J.C.2
-
13
-
-
0025080065
-
Introduction: Structural properties for determining mechanisms of toxic action
-
Bradbury, S. P., and Lipnick, R. L. (1990). Introduction: Structural properties for determining mechanisms of toxic action. Environ. Health Perspect. 87, 181-182.
-
(1990)
Environ. Health Perspect.
, vol.87
, pp. 181-182
-
-
Bradbury, S.P.1
Lipnick, R.L.2
-
14
-
-
0026340858
-
Outliers: Their origin and use in the classification of molecular mechanisms of toxicity
-
Lipnick, R. L. (1991). Outliers: their origin and use in the classification of molecular mechanisms of toxicity. Sci. Total Environ. 109/110, 131-153.
-
(1991)
Sci. Total Environ.
, vol.109-110
, pp. 131-153
-
-
Lipnick, R.L.1
-
15
-
-
0030907236
-
Correspondence analysis of the skin sensitization potential of organic chemicals
-
Cronin, M. T. D., and Dearden, J. C. (1997) Correspondence analysis of the skin sensitization potential of organic chemicals. Quant. Struct.-Act. Relat. 16, 33-37.
-
(1997)
Quant. Struct.-Act. Relat.
, vol.16
, pp. 33-37
-
-
Cronin, M.T.D.1
Dearden, J.C.2
-
16
-
-
3042859635
-
Alternative methods for skin sensitization testing. the report and recommendations of ECVAM Workshop 19
-
de Silva, O., Basketter, D. A., Barratt, M. D., Corsini, E., Cronin, M. T. D., Das, P. K., Degwert, J., Enk, A., Garrigue, J. L., Hauser, C., Kimber, I., Lepoittevin, J.-P., Peguet, J., and Ponec, M. (1996) Alternative methods for skin sensitization testing. The report and recommendations of ECVAM Workshop 19. ATLA 24, 683-705.
-
(1996)
ATLA
, vol.24
, pp. 683-705
-
-
De Silva, O.1
Basketter, D.A.2
Barratt, M.D.3
Corsini, E.4
Cronin, M.T.D.5
Das, P.K.6
Degwert, J.7
Enk, A.8
Garrigue, J.L.9
Hauser, C.10
Kimber, I.11
Lepoittevin, J.-P.12
Peguet, J.13
Ponec, M.14
-
17
-
-
0006178062
-
Structure-activity relationships for skin sensitization: An expert system
-
Rougier, A., Goldberg, A. M., and Maibach, H. I., Eds., Mary Ann Liebert, New York
-
Barratt, M. D., and Basketter, D. A. (1994) Structure-activity relationships for skin sensitization: an expert system. In In vitro skin toxicology: irritation, phototoxicity, sensitization (Rougier, A., Goldberg, A. M., and Maibach, H. I., Eds.) pp 293-301, Mary Ann Liebert, New York.
-
(1994)
In Vitro Skin Toxicology: Irritation, Phototoxicity, Sensitization
, pp. 293-301
-
-
Barratt, M.D.1
Basketter, D.A.2
-
18
-
-
0028167546
-
Structure-activity relationships for skin sensitization potential: Development of structural alerts for use in knowledge-based toxicity prediction systems
-
Payne, M. P., and Walsh, P. T. (1994) Structure-activity relationships for skin sensitization potential: development of structural alerts for use in knowledge-based toxicity prediction systems. J. Chem. Inf. Comput. Sci. 34, 154-161.
-
(1994)
J. Chem. Inf. Comput. Sci.
, vol.34
, pp. 154-161
-
-
Payne, M.P.1
Walsh, P.T.2
-
19
-
-
0002668077
-
Tetrahymena in aquatic toxicology: QSARs and ecological hazard assessment
-
Pauli, W., and Berger, S., Eds., German Federal Environmental Agency, Mauerstrasse 45-52, 14191 Berlin
-
Schultz, T. W. (1996) Tetrahymena in aquatic toxicology: QSARs and ecological hazard assessment. In Proceedings of the International Workshop on a Protozoan Test Protocol with Tetrahymena in Aquatic Toxicity Testing (Pauli, W., and Berger, S., Eds.) pp 31-66, German Federal Environmental Agency, Mauerstrasse 45-52, 14191 Berlin.
-
(1996)
Proceedings of the International Workshop on a Protozoan Test Protocol with Tetrahymena in Aquatic Toxicity Testing
, pp. 31-66
-
-
Schultz, T.W.1
-
20
-
-
0004425240
-
-
SAS, Cary, NC
-
SAS Institute Inc. (1989) SAS/STAT User's Guide, version 6, 4th ed., Vol. 2, p 846, SAS, Cary, NC.
-
(1989)
SAS/STAT User's Guide, Version 6, 4th Ed
, vol.2
, pp. 846
-
-
-
21
-
-
0023325062
-
Strategic approaches to drug design. Integrated software framework for molecular modeling
-
Vinter, J. G., Davis, A., and Saunders: M. R. (1987) Strategic approaches to drug design. Integrated software framework for molecular modeling. J. Comput.-Aided Mol. Des. 1, 31-51.
-
(1987)
J. Comput.-Aided Mol. Des.
, vol.1
, pp. 31-51
-
-
Vinter, J.G.1
Davis, A.2
Saunders, M.R.3
-
22
-
-
0004180672
-
-
Frank J. Seiler Research Laboratory, U.S. Air Force Academy, Colorado Springs, CO
-
Stewart, J. J. P. (1990) MOPAC Manual (6th ed.) p 189, Frank J. Seiler Research Laboratory, U.S. Air Force Academy, Colorado Springs, CO.
-
(1990)
MOPAC Manual (6th Ed.)
, pp. 189
-
-
Stewart, J.J.P.1
-
23
-
-
0842341771
-
The development and use of quantum-mechanical models. 76. AMI -A new general-purpose quantum-mechanical molecular model
-
Dewar, M. J. S., Zoebisch, E. G., Healy, E. F., and Stewart, J. J. P. (1985) The development and use of quantum-mechanical models. 76. AMI -A new general-purpose quantum-mechanical molecular model. J. Am. Chem. Soc. 107, 3902-3909.
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 3902-3909
-
-
Dewar, M.J.S.1
Zoebisch, E.G.2
Healy, E.F.3
Stewart, J.J.P.4
-
24
-
-
0001608903
-
Theory of substitution in conjugated molecules
-
Fukui, K., Yonezawa, T., and Nagata, C. (1954) Theory of substitution in conjugated molecules. Bull. Chem. Soc. Jpn. 27, 423-427.
-
(1954)
Bull. Chem. Soc. Jpn.
, vol.27
, pp. 423-427
-
-
Fukui, K.1
Yonezawa, T.2
Nagata, C.3
-
25
-
-
0029813829
-
Quantum-chemical descriptors for estimating the acute toxicity of substituted benzenes to the guppy (Poecilia reticulata) and the fathead minnow (Pimephales promelas)
-
Karabunarliev, S., Mekenyan, O. G., Karcher, W., Russom, C. L., and Bradbury, S. P. (1996) Quantum-chemical descriptors for estimating the acute toxicity of substituted benzenes to the guppy (Poecilia reticulata) and the fathead minnow (Pimephales promelas). Quant. Struct.-Act. Relat. 15, 311-320.
-
(1996)
Quant. Struct.-Act. Relat.
, vol.15
, pp. 311-320
-
-
Karabunarliev, S.1
Mekenyan, O.G.2
Karcher, W.3
Russom, C.L.4
Bradbury, S.P.5
-
26
-
-
84987083710
-
Validation of QSAR's
-
Wold, S. (1991) Validation of QSAR's. Quant. Struct.-Act. Relat. 10, 191-193.
-
(1991)
Quant. Struct.-Act. Relat.
, vol.10
, pp. 191-193
-
-
Wold, S.1
-
27
-
-
0031556538
-
QSAR treatment of multiple toxicities: The mutagenicity and cytotoxicity of quinones
-
Smith, C. F., Hansch, C., Morton, M. J. (1997) QSAR treatment of multiple toxicities: the mutagenicity and cytotoxicity of quinones. Mutat. Res. 379, 167-175.
-
(1997)
Mutat. Res.
, vol.379
, pp. 167-175
-
-
Smith, C.F.1
Hansch, C.2
Morton, M.J.3
-
28
-
-
0029595333
-
Structure activity relationships in skin sensitization using the murine local lymph node assay
-
Ashby, J., Basketter, D. A., Paton, D., and Kimber, I. (1995) Structure activity relationships in skin sensitization using the murine local lymph node assay. Toxicology 103, 177-194.
-
(1995)
Toxicology
, vol.103
, pp. 177-194
-
-
Ashby, J.1
Basketter, D.A.2
Paton, D.3
Kimber, I.4
-
29
-
-
85025403160
-
Studies on the sensitization of animals with simple chemical compounds. II
-
Landsteiner, K., and Jacobs, J. (1936) Studies on the sensitization of animals with simple chemical compounds. II. J. Exp. Med. 64, 625-639.
-
(1936)
J. Exp. Med.
, vol.64
, pp. 625-639
-
-
Landsteiner, K.1
Jacobs, J.2
-
30
-
-
0000941392
-
Structure-toxicity relationships for industrial chemicals causing type (II) narcosis syndrome
-
Kaiser, K. L. E., Ed., D. Reidel, Dordrecht, The Netherlands
-
Veith, G. D., and Broderius, S. J. (1986) Structure-toxicity relationships for industrial chemicals causing type (II) narcosis syndrome. In QSAR in Environmental Toxicology -II (Kaiser, K. L. E., Ed.) pp 385-391, D. Reidel, Dordrecht, The Netherlands.
-
(1986)
QSAR in Environmental Toxicology -II
, pp. 385-391
-
-
Veith, G.D.1
Broderius, S.J.2
-
31
-
-
0001512805
-
CoMFA study of acute toxicity of nitrobenzenes to Tetrahymena pyriformis
-
Chen, F., and Schüürmann, G., Eds., SETAC Press, Pensacola, FL
-
Schüürmann, G., Flemmig, B., Dearden, J. C., Cronin, M. T. D., Schultz, T. W., and Lin, D. T. (1997) CoMFA study of acute toxicity of nitrobenzenes to Tetrahymena pyriformis. In QSAR in Environmental Sciences -VII (Chen, F., and Schüürmann, G., Eds.) pp 329-342, SETAC Press, Pensacola, FL.
-
(1997)
QSAR in Environmental Sciences -VII
, pp. 329-342
-
-
Schüürmann, G.1
Flemmig, B.2
Dearden, J.C.3
Cronin, M.T.D.4
Schultz, T.W.5
Lin, D.T.6
-
32
-
-
0028382023
-
Structure-toxicity relationships for Tetrahymena: Aliphatic aldehydes
-
Schultz, T. W., Bryant, S. E., and Lin, D. T. (1994) Structure-toxicity relationships for Tetrahymena: aliphatic aldehydes. Bull. Environ. Contam, Toxicol. 52, 279-285.
-
(1994)
Bull. Environ. Contam, Toxicol.
, vol.52
, pp. 279-285
-
-
Schultz, T.W.1
Bryant, S.E.2
Lin, D.T.3
-
33
-
-
0014874208
-
On the parabolic relationship between drug potency and hydrophobicity
-
McFarland, J. W. (1970) On the parabolic relationship between drug potency and hydrophobicity. J. Med. Chem. 13, 1092-1196.
-
(1970)
J. Med. Chem.
, vol.13
, pp. 1092-1196
-
-
McFarland, J.W.1
-
34
-
-
0029926824
-
Structure-toxicity relationships for phenols to Tetrahymena pyriformis
-
Cronin, M. T. D., and Schultz, T. W. (1996) Structure-toxicity relationships for phenols to Tetrahymena pyriformis. Chemosphere 32, 1453-1468.
-
(1996)
Chemosphere
, vol.32
, pp. 1453-1468
-
-
Cronin, M.T.D.1
Schultz, T.W.2
|