Below are selected publications from 2007; please check here to cite the use of Jaguar

• •  Berrios, C.; Cardenas-Jiron, G.; Marco, J.; Gutierrez, C.; Ureta-Zanartu, M., "Theoretical and Spectroscopic Study of Nickel(II) Porphyrin Derivatives," J. Phys. Chem. A, 2007, 111, 2706-2714
• •  Cheng, M.; Chenoweth, K.; Oxgaard, J.; vanDuin, A.; Goddard, W., "Single-Site Vanadyl Activation, Functionalization, and Reoxidation Reaction Mechanism for Propane Oxidative Dehydrogenation on the Cubic V4O10 Cluster," J. Phys. Chem. C, 2007, 111, 5115-5127
• •  Dede, M.; Drexler, M.; Fischer, H., "Heptahexaenylidene Complexes: Synthesis and Characterization of the First Complexes with an M=C=C=C=C=C=C=CR2 Moiety (M = Cr, W)," Organometallics, 2007, 26, 4294-4299
• •  Hagmayer, S.; Früh, A.; Haas, T.; Drexler, M.; Fischer, H., "Unprecedented Formation of Azulenylidene Ligands by Reaction of the Vinylidene Ligand in Arylvinylidene Pentacarbonyl Complexes of Chromium and Tungsten with Alkoxyacetylenes," Organometallics, 2007, 26, 3791-3801
• •  Hao, M.; Haq, O.; Muegge, I., "Torsion angle preference and energetics of small-molecule ligands bound to proteins," J. Chem. Inf. Model, 2007, 47, 2242-2252
• •  Jordan, B. J.; Pollier, M. A.; Miller, L. A.; Tiernan, C.; Clavier, G.; Audebert, P.; Rotello, V.M., "Redox-Modulated Recognition of Tetrazines Using Thioureas," Org. Lett., 2007, 9, 2835–2838
• •  Keith, J.; Behenna, D.C.; Mohr, J.T.; Ma, S.; Marinescu, S.C.; Oxgaard, J.; Stoltz, B.M., Goddard, W.A., "The inner-sphere process in the enantioselective Tsuji allylation reaction with (S)-t-Bu-phosphinooxazoline ligands," J. Am. Chem. Soc., 2007, 129, 11876-11877
• •  Pissarnitski, D.A.; Asberom, T.; Bara, T.A.; Buevich, A.V.; Clader, J.W.; Greenlee, W.J.; Guzik, H.S.; Josien, H.B.; Li, W.; McEwan, M.; McKittrick, B.A.; Nechuta, T.L.; Parker, E.M.; Sinning, L.; Smith, E.M.; Song, L.; Vaccaro, H.A.; Voigt, J.H.; Zhang, , "2,6-Disubstituted N-arylsulfonyl piperidines as gamma-secretase inhibitors," Bioorganic & Medicinal Chemistry Letters, 2007, 17, 57-62
• •  Quinn, J.; Foss, F.; Venkataraman, L.; Hybertsen, M.; Breslow, R., "Single-Molecule Junction Conductance through Diaminoacenes," J. Am. Chem. Soc., 2007, 129, 6714-6715
• •  Szczepanska, A.; Espartero, J.L.; Moreno-Vargas, A.J.; Carmona, A.T.; and Robina, I.; Remmert, S.; and Parish, C., "Synthesis and conformational analysis of novel trimeric maleimide cross-linking reagents," J. Org. Chem., 2007, 72, 6776-6785
• •  Venkataraman, L.; Park, Y.; Whalley, A.; Nuckolls, C.; Hybertsen, M.; Steigerwald, M., "Electronics and Chemistry: Varying Single-Molecule Junction Conductance Using Chemical Substituents," Nano Letters, 2007, 7, 502-506
• •  ö  Wang, Y.; Haze, O.; Dinnocenzo, J.P.; Farid, S.; Farid, R.S.; Gould, I.R., "Bonded Exciplexes. A New Concept in Photochemical Reactions," J. Org. Chem., 2007, 72, 6970-6981

• ö indicates papers (co)authored by Schrödinger scientist(s).