Binding Affinities of Host-Guest, Protein-Ligand, and Protein-Transition-State Complexes von Houk, K. N., Leach, Andrew G., Kim, Susanna P., Zhang, Xiyun

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A Standard Set of Pericyclic Reactions of Hydrocarbons for the Benchmarking of Computational Methods:  The Performance of ab Initio, Density Functional, CASSCF, CASPT2, and CBS-QB3... von Guner, Vildan, Khuong, Kelli S., Leach, Andrew G., Lee, Patrick S., Bartberger, Michael D., Houk, K. N.

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Diels-Alder and ene reactions of singlet oxygen, nitroso compounds and triazolinediones: transition states and mechanisms from contemporary theory von Leach, Andrew G, Houk, K N

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Mechanism of Ene Reactions of Singlet Oxygen. A Two-Step No-Intermediate Mechanism von Singleton, Daniel A, Hang, Chao, Szymanski, Michael J, Meyer, Matthew P, Leach, Andrew G, Kuwata, Keith T, Chen, Jenny S, Greer, Alexander, Foote, Christopher S, Houk, K. N

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A System for Encoding and Searching Markush Structures von Cosgrove, David A, Green, Keith M, Leach, Andrew G, Poirrette, Andrew, Winter, Jon

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Transition States and Mechanisms of the Hetero-Diels−Alder Reactions of Hyponitrous Acid, Nitrosoalkanes, Nitrosoarenes, and Nitrosocarbonyl Compounds von Leach, Andrew G, Houk, K. N

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The Ene Reactions of Nitroso Compounds Involve Polarized Diradical Intermediates von Leach, Andrew G, Houk, K. N

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A Cornucopia of Cycloadducts:  Theoretical Predictions of the Mechanisms and Products of the Reactions of Cyclopentadiene with Cycloheptatriene von Leach, Andrew G, Goldstein, E, Houk, K. N

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The mechanism and regioselectivity of the ene reactions of nitroso compounds: a theoretical study of reactivity, regioselectivity, and kinetic isotope effects establishes a stepwis... von Leach, Andrew G, Houk, K N

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Multi-step organic synthesis using solid-supported reagents and scavengers: a new paradigm in chemical library generation von Ley, Steven V., Baxendale, Ian R., Bream, Robert N., Jackson, Philip S., Leach, Andrew G., Longbottom, Deborah A., Nesi, Marcella, Scott, James S., Storer, R. Ian, Taylor, Stephen J.

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The Origins of Noncovalent Catalysis of Intermolecular Diels−Alder Reactions by Cyclodextrins, Self-Assembling Capsules, Antibodies, and RNAses von Kim, Susanna P, Leach, Andrew G, Houk, K. N

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The Origins of Periselectivity and Substituent Effects in Electrocyclizations of o-Nitrosostyrenes: A Computational Study von Leach, Andrew G., Houk, K. N., Davies, Ian W.

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Inhibitors of epidermal growth factor receptor tyrosine kinase: Novel C-5 substituted anilinoquinazolines designed to target the ribose pocket von Ballard, Peter, Bradbury, Robert H., Harris, Craig S., Hennequin, Laurent F.A., Hickinson, Mark, Johnson, Paul D., Kettle, Jason G., Klinowska, Teresa, Leach, Andrew G., Morgentin, Remy, Pass, Martin, Ogilvie, Donald J., Olivier, Annie, Warin, Nicolas, Williams, Emma J.

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Theoretical Elucidation of Kinetic and Thermodynamic Control of Radical Addition Regioselectivity von Leach, Andrew G, Wang, Renxiao, Wohlhieter, G. Erich, Khan, Saeed I, Jung, Michael E, Houk, K. N

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Mechanism of the Forbidden [3s,5s]-Sigmatropic Shift: Orbital Symmetry Influences Stepwise Mechanisms Involving Diradical Intermediates von Leach, Andrew G., Catak, Saron, Houk, K. N.

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Unexpected Syn Hydride Migration in the Non-aldol Aldol Reaction von Jung, Michael E, van den Heuvel, Alexandra, Leach, Andrew G, Houk, K. N

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Theoretical Investigation of the Origins of Catalysis of a Retro-Diels−Alder Reaction by Antibody 10F11 von Leach, Andrew G, Houk, K. N, Reymond, Jean-Louis

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Energy Contour Plots: Slices through the Potential Energy Surface That Simplify Quantum Mechanical Studies of Reacting Systems von Goldstein, E, Leach, Andrew G

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A polymer-supported thionating reagent von Ley, Steven V., Leach, Andrew G., Storer, R. Ian

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Fragment-oriented synthesis: β-elaboration of cyclic amine fragments using enecarbamates as platform intermediates von Trindade, AF, Faulkner, EL, Leach, AG, Nelson, A, Marsden, SP

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