A Structure-Activity Prediction Model of Carcinogenicity Based on Nci/Ntp Assays and Food Additives

Belsley, D.A. , Kuh, E. and Welsch, R.E. (1980). Regression Diagnostics. Wiley , New York.

Chou, J.T. and Jurs, P.C. (1979). Computer-assisted structure-activity studies of chemical carcinogens. N-nitroso compounds. J. Med. Chem. 2:762-797.

CODE OF FEDERAL REGULATIONS, Food and Drugs. (1979). Vol. 21. Superintendent of Documents, Washington, DC 20402.

Costanza, M.C. and Afifi, A.A. (1979). Comparison of stopping rules in forward stepwise discriminant analysis. J. Am. Stat. Assn. 74:777-785.

Daudin, J.J. (1986). Selection of variables in mixed-variable discriminant analysis. Biometrics 42:473-481.

Eakin, D.L. , Hyde, E. and Parker, G. (1974). The CROSSBOW system. Pesticide Science 5:319-326.

Enslein, K. , Ralston, A. and Wilf, H.S. , eds. ( 1977). Statistical Methods for Digital Computers. Wiley, New York.

Enslein, K. and Craig, P.N. (1982). Carcinogenesis: a predictive structure-activity model. J. Tox. Env. Health 10:521-530.

Enslein, K. , Lander, T.R. , Tomb, M.E. and Landis, W.G. (1983). Mutagenicity (Ames): a structure-activity model . J. Teratogenesis, Carcinogenesis and Mutagenesis 3:503-514.

Enslein, K. (1984a). Estimation of toxicological endpoints by structure-activity relationships. Pharmacological Reviews 36:131S-135S.

Enslein, K. (1984b). HDI develops SAR model for rabbit skin irritation (Draize). HDI Toxicology Newsletter 3:1-2.

Glick, N. (1978). Additive estimators for probabilities of correct classification. Pattern Recognition 10:211-222.

Gold, L.S. , Sawyer, C.B. et al. (1984). A carcinogenic potency data base of the standardized results of animal bioassays. Env. Health Perspectives , December.

Griesemer, R.A. and Cueto, C. (1980). Toward a classification scheme for degrees of experimental evidence for the carcinogenicity of chemicals for animals. IARC Scientific Publications 27:259-281.

Hansch, C. and Leo, A. (1979). Substituent Constants for Correlation Analysis in Chemistry and Biology. J. Wiley & Sons, New York.

Iarc. (1972). IARC Monog. Eval. Carcinog. Risk Chem. Hum. 1-28, 1972-ff.

Jurs, P.C. , Chou, J.T. and Yuan, M. (1979). Computer-assisted studies of chemical carcinogens—a heterogeneous data set. J. Med. Chem. 22:476-483.

Kier, L.B. and Hall, L.H. (1976). Molecular Connectivity in Chemistry and Drug Research . Academic Press, New York.

Leo, A. and Weininger, D. (1984). CLOGP3, Version 3.2. User Reference Manual. Medical Chemistry Project. Pomona College, Claremont, CA.

Marquardt, D.W. and Snee, R.D. (1975). Ridge regression in practice. Amer. Statistician 29:3-20.

Phs 149. (1976-1977). Survey of Compounds Which Have Been Tested for Carcinogenic Activity. NIH Publication No. 84-2631, DHHS, NCI, Bethesda, MD.

Snapinn, S.M. and Knoke, J.D. (1984). Classification error-rate estimators evaluated by unconditional mean squared error. Technometrics 26:371-378.

Wishnok, J.S. and Archer, M.C. (1976). Structure-activity relationships in nitrosamine carcinogenesis. Br. J. Cancer 33:307-311.

Wishnok, J.S. , Archer, M.C. , Edelman, E.S. and Rand, W.M. (1978). Nitrosamine carcinogenicity: a quantitative Hansch-Taft structure-activity relationship. Chem.-Biol. Interactions 20:43-54.

Yuan, M. and Jurs, P.C. (1980). Computer-assisted studies of chemical carcinogens. Polycyclic aromatic hydrocarbons. Toxicol. Appl. Pharmacol. 52:294-312.

Yuta, K. and Jurs, P.C. (1981). Computer-assisted studies of chemical carcinogens. Aromatic amines. J. Med. Chem. 24:241-251.