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Publisher: Taylor and Francis Ltd

Volume 13, Number 1, 2002

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Modelling mutagenicity using properties calculated by computational chemistry
pp. 21-33(13)
Authors: Livingstone, D.J.; Greenwood, R.; Rees, R.; Smith, M.D.

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An approach to the interpretation of backpropagation neural network models in QSAR studies
pp. 35-41(7)
Authors: Baskin, I.I.; Ait, A.O.; Halberstam, N.M.; Palyulin, V.A.; Zefirov, N.S.

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An integrated "4-phase" approach for setting endocrine disruption screening priorities--phase I and II predictions of estrogen receptor binding affinity
pp. 69-88(20)
Authors: Shi‡, L.; Tong, W.; Fang, H.; Xie, Q.; Hong, H.; Perkins, R.; Wu, J.; Tu§, M.; Blair, R.M; Branham, W.S; Waller, C.; Walker, J.; Sheehan, D.M.

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Decision support systems for chemical structure representation, reaction modeling, and spectra simulation
pp. 89-110(22)
Authors: Gasteiger, J.; Bauerschmidt, S.; Burkard, U.; Hemmer, M.C.; Herwig, A.; von Homeyer, A.; Höllering, R.; Kleinöder, T.; Kostka, T.; Schwab, C.; Selzer, P.; Steinhauer, L.

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Bayesian analysis and inference from QSAR predictive model results*
pp. 111-125(15)
Authors: McDowell, R.M.; Jaworska, J.S.

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Membrane-contaminant interaction found by 3D force field calculations
pp. 135-143(9)
Authors: Govers, H.A.J.; de Voogt, P.; Kwast, O.; Bleeker, E.A.J.

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QSAR's based on partial order ranking
pp. 153-165(13)
Authors: Carlsen, L.; SØrensen, P. B.; Thomsen, M.; Brüggemann, R.

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The importance of hydrophobicity and electrophilicity descriptors in mechanistically-based QSARs for toxicological endpoints
pp. 167-176(10)
Authors: Cronin, M.T.D.; Dearden, J.C.; Duffy, J.C.; Edwards, R.; Manga, N.; Worth, A.P.; Worgan, A.D.P.

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Non-linear modeling of bioconcentration using partition coefficients for narcotic chemicals
pp. 177-184(8)
Authors: Dimitrov, S.D.; Mekenyan, O.G.; Walker, J.D.

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Prediction of biodegradability from structure: imidazoles
pp. 199-204(6)
Authors: Rorije, E.; Germa, F.; Philipp, B.; Schink, B.; Beimborn, D.B.

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