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Total result(s) found: 7
  • Organocatalytic Conjugate-Addition Polymerization of Linear and Cyclic Acrylic Monomers by N-Heterocyclic Carbenes: Mechanisms of Chain Initiation, Propagation, and Termination
    Y. Zhang, M. Schmitt, L. Falivene, L. Caporaso, L. Cavallo, E.Y.X. Chen
    J. Am. Chem. Soc. 135, 17925, (2013)
Keywords:
Computational studies, Conjugate addition, High molecular weight, Initiator efficiency, Methyl methacrylates, N-heterocyclic carbenes, Polymerization activity, Turnover frequency
  • Using a Consensus Approach Based on the Conservation of Inter-Residue Contacts to Rank CAPRI Models
    A. Vangone, L. Cavallo, R. Oliva
    Proteins 81, 2210, (2013)
Keywords:
CAPRI, CONS-COCOMAPS, Consensus, CONSRANK, Docking models, Inter-molecular contacts, Protein-protein interactions, Ranking, Scoring
  • The Activation Mechanism of Ru-Indenylidene Complexes in Olefin Metathesis
    C.A. Urbina-Blanco, A. Poater, T. Lebl, S. Manzini, A.M.Z. Slawin, L. Cavallo, S.P. Nolan
    J. Am. Chem. Soc. 135, 7073, (2013)
Keywords:
Activation mechanisms, Carbon-carbon double bonds, Initiation mechanism, Olefin metathesis, Olefin metathesis reactions, Reaction mechanism, Single mechanisms, Spectator ligands
  • Concepts for Stereoselective Acrylate Insertion
    B. Neuwald, L. Caporaso, L. Cavallo, S. Mecking
    J. Am. Chem. Soc. 135, 1026, (2013)
Keywords:
Aryl substituents, DFT method, Free ligands, Insertion rates, Line shape analysis, Methyl acrylates, Molecular motions, Palladium complexes, Phosphorus atom, Stereo-selective, Stereocontrol, Steric bulk, Substitution patterns, Transition state
  • Understanding Tantalum-Catalyzed Ethylene Trimerization: When Things Go Wrong
    Y. Chen, R. Credendino, E. Callens, M. Atiqullah, M.A. Al-Harthi, L. Cavallo, J.-M. Basset
    ACS Catalysis 3, 1360, (2013)
Keywords:
Ethylene oligomerization, Ethylene polymerization, Heterogeneous catalysis, Surface organometallic chemistry, Tantalum catalysis
  • The Isolation of Pd{OC(O)H}(H)(NHC)(PR3) (NHC = N-Heterocyclic Carbene) and Its Role in Alkene and Alkyne Reductions Using Formic Acid
    J. Broggi, V. Jurcik, O. Songis, A. Poater, L. Cavallo, A.M.Z. Slawin, C.S.J. Cazin
    J. Am. Chem. Soc. 135, 4588, (2013)
Keywords:
Computational studies, Multiple bonds, N-heterocyclic carbenes, Palladium complexes, Tandem process, Tandem sequence
  • Enantioselective Polymerization of Epoxides Using Biaryl-Linked Bimetallic Cobalt Catalysts: A Mechanistic Study
    S.M. Ahmed, A. Poater, M.I. Childers, P.C.B. Widger, A.M. La Pointe, E.B. Lobkovsky, G.W. Coates, L. Cavallo
    J. Am. Chem. Soc. 135, 18901, (2013)
Keywords:
Absolute stereochemistry, Bimetallic catalysts, Carboxylate ligands, Catalytic system, Mechanistic studies, Stereo-selective, Structural feature, Structural information