A priori Prediction of Adsorption Isotherm Parameters and Chromatographic Behavior in Ion-Exchange Systems von Ladiwala, Asif, Rege, Kaushal, Breneman, Curtis M., Cramer, Steven M., Prausnitz, John M.

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High-throughput screening and quantitative structure-efficacy relationship models of potential displacer molecules for ion-exchange systems von Mazza, Cecilia B., Rege, Kaushal, Breneman, Curt M., Sukumar, N., Dordick, Jonathan S., Cramer, Steven M.

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Resonance interactions in acyclic systems. 1. Energies and charge distributions in allyl anions and related compounds von Wiberg, Kenneth B, Breneman, Curtis M, LePage, Teresa J

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Azines. A theoretical study of .pi.-electron delocalization von Wiberg, Kenneth B, Nakaji, David, Breneman, Curtis M

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Substituted naphthalene reaction rates with peroxy-acid treatment: prediction of reactivity using PEST von J.M. Shoulder, E.L. Ashenafi, C.M. Breneman, M.C. Nyman

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Experimental and theoretical study of the energetics of trialkylsulfonium ions von Deakyne, C.A., Knuth, D.M., Meot-Ner, M., Breneman, C.M., Liebman, J.F.

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Feature selection for in-silico drug design using genetic algorithms and neural networks von Ozdemir, M., Embrechts, M.J., Arciniegas, F., Breneman, C.M., Lockwood, L., Bennett, K.P.

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Strip mining for molecules von Embrechts, M.J., Arciniegas, F., Ozdemir, M., Momma, M., Breneman, C.M., Lockwood, L., Bennett, K.P., Kewley, R.H.

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Bagging neural network sensitivity analysis for feature reduction for in-silico drug design von Embrechts, M.J., Arciniegas, F., Ozdemir, M., Breneman, C.M., Bennett, K., Lockwood, L.

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