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	Title	Authors / Editors	Date
unige:3223	Analysis of paramagnetic NMR spectra of triple-helical lanthanide complexes with 2,6-dipicolinic acid revisited : a new assignment of structural changes and crystal-field effects 25 years later	Ouali, Nadjet; Bocquet, Bernard; Rigault, Stéphane; Morgantini, Pierre-Yves; ... Piguet, Claude	2002
unige:3222	Aromatic bent-core liquid crystals : an opportunity for introducing terdentate binding units into mesophases	Nozary, Homayoun; Rivera, Jean-Pierre; Tissot, Paul; Piguet, Claude; ... Guillon, Daniel	2002
unige:2937	Binding of Organic Cations to a Cyclophane Host As Studied with Molecular Dynamics Simulations and Free Energy Calculations	Eriksson, Mats A. L.; Morgantini, Pierre-Yves; Kollman, Peter A.	1999
unige:3049	Calculation and visualization of a reactivity index for organometallics based on the extended Hückel model	Weber, Jacques; Fluekiger, Peter Frank; Stussi, Dominique; Morgantini, Pierre-Yves	1991
unige:4048	Chemical reactivity and molecular shape interactions	Weber, Jacques; Stussi, Dominique; Morgantini, Pierre-Yves	1994
unige:2861	Comparative modelling studies on 3,6-substituted 1,2,4-trioxan-5-ones	Jefford, Charles William; Bernardinelli, Gérald Hugues; Josso, Martin C.; Morgantini, Pierre-Yves; Weber, Jacques	1995
unige:2930	Computer modeling of the activation processes of the aromatic nucleophilic substitution mechanism	Morgantini, Pierre-Yves; Fluekiger, Peter Frank; Weber, Jacques	1992
unige:3950	Computer-aided design of organometallic compounds : a semi-empirical approach of their structure and reactivity	Weber, Jacques; Savary, François; Stussi, Dominique; Morgantini, Pierre-Yves	1993
unige:3236	Connecting Terminal Carboxylate Groups in Nine-Coordinate Lanthanide Podates: Consequences on the Thermodynamic, Structural, Electronic, and Photophysical Properties	Senegas, Jean-Michel; Bernardinelli, Gérald Hugues; Imbert, Daniel; Bünzli, Jean-Claude G.; ... Piguet, Claude	2003
unige:3344	Coupled-cluster calculations on ferrocene and its protonated derivatives : the final word on the mechanism of protonation of ferrocene ?	Mayor-Lopez, M.J.; Lüthi, H.P.; Koch, H.; Morgantini, Pierre-Yves; Weber, Jacques	2000
unige:3240	Density Functional Study of a Helical Organic Cation	Bas, Delphine; Morgantini, Pierre-Yves; Weber, Jacques; Wesolowski, Tomasz Adam	2003
unige:2915	Development and applications of an extended-Hückel-based reactivity index for organometallic complexes	Weber, Jacques; Stussi, Dominique; Flükiger, Peter; Morgantini, Pierre-Yves; Kundig, Ernst Peter	1992
unige:3788	How much correlation can we expect to account for in density functional calculations ? Case studies of electrostatic properties of small molecules	Weber, Jacques; Jaber, P.; Gulbinat, P.; Morgantini, Pierre-Yves	2002
unige:3235	Intermolecular interaction energies from the total energy bi-functional. A case study of carbazole complexes	Wesolowski, Tomasz Adam; Morgantini, Pierre-Yves; Weber, Jacques	2002
unige:3052	Modeling of organometallic reactivity using a combination of extended Hueckel and molecular graphics techniques	Morgantini, Pierre-Yves; Flükiger, Peter; Weber, Jacques; Kundig, Ernst Peter	1990
unige:2907	Molecular graphics and chemistry	Weber, Jacques; Flükiger, Peter; Morgantini, Pierre-Yves	1992
unige:2934	Molecular graphics investigation of the addition of nucleophiles to (η4:butadiene) M(CO)3 complexes (M=Fe,Co+)	Weber, Jacques; Morgantini, Pierre-Yves; Eisenstein, Odile	1992
unige:22645	Optimizing Millisecond Time Scale Near-Infrared Emission in Polynuclear Chrome(III)–Lanthanide(III) Complexes	Aboshyan Sorgho, Lilit; Nozary, Homayoun; Aebischer, Annina; Bünzli, Jean-Claude G.; ... Piguet, Claude	2012
unige:3043	Recent developments in molecular graphics : visualization of chemical structures and properties	Weber, Jacques; Morgantini, Pierre-Yves; Fluekiger, Peter Frank; Goursot, Annick	1991
unige:2988	Solvation Free Energies of Amides and Amines: Disagreement between Free Energy Calculations and Experiment	Morgantini, Pierre-Yves; Kollman, Peter A.	1995

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