Search Results - "Breneman, Curtis M"

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

“…The a priori prediction of protein adsorption behavior has been a long-standing goal in several fields. In the present work, property-modeling techniques have…”
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Prediction of pH-Dependent Chromatographic Behavior in Ion-Exchange Systems by Yang, Ting, Sundling, Matthew C, Freed, Alexander S, Breneman, Curtis M, Cramer, Steven M

“…In this study, predictive quantitative structure−property relationship (QSPR) models that employed a support vector machine regression algorithm and a set of…”
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High Throughput Determination and QSER Modeling of Displacer DC-50 Values for Ion Exchange Systems by Liu, Jia, Yang, Ting, Ladiwala, Asif, Cramer, Steven M., Breneman, Curtis M.

“…In this paper, the displacer concentration required to displace 50% of proteins bound in batch adsorption systems, DC-50, was employed as a means of ranking…”
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Resonance interactions in acyclic systems. 1. Energies and charge distributions in allyl anions and related compounds by Wiberg, Kenneth B, Breneman, Curtis M, LePage, Teresa J

“…The energies of dissociation of propane to 1-propyl cation and anion and of propene to allyl cation and anion may be satisfactorily reproduced via ab initio…”
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Azines. A theoretical study of .pi.-electron delocalization by Wiberg, Kenneth B, Nakaji, David, Breneman, Curtis M

“…{pi}-electron delocalization in benzene and the azines has been studied theoretically in several ways: via an analysis of the first {pi} {yields} {pi}*…”
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Resonance interactions in acyclic systems by Wiberg, K. B., Breneman, C. M., Laidig, K. E., Rosenberg, R. E.

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