Département de chimie moléculaire

Chemically and Electrochemically Triggered Assembly of Viologen Radicals: Towards Multiaddressable Molecular Switches., Kahlfuss, Christophe, Metay Estelle, Duclos Marie-Christine, Lemaire Marc, Milet Anne, Saint-Aman Eric, and Bucher Christophe , Chem. - A Eur. J., Volume 21, Number 5, p.2090–2106, (2015)

Experimental and Computational Insights into Carbon Dioxide Fixation by RZnOH Species., Sokolowski, Kamil, Bury Wojciech, Tulewicz Adam, Cieslak Anna M., Justyniak Iwona, Kubicki Dominik, Krajewska Elzbieta, Milet Anne, Moszynski Robert, and Lewinski Janusz. , Chem. - A Eur. J., Volume 21, Number 14, p.5496–5503, (2015)

Hydrogen-Bond Controlled π-Dimerization in Viologen-Appended Calixarenes: Revealing a Subtle Balance of Weak Interactions., Kahlfuss, Christophe, Milet Anne, Wytko Jennifer, Weiss Jean, Saint-Aman Eric, and Bucher Christophe , Org. Lett., Volume 17, Number 16, p.4058–4061, (2015)

Kinetic Resolution in the [2+2] Cycloaddition of Ketenes: An Experimental and Theoretical Study., Rullière, Pauline, Carret Sébastien, Milet Anne, and Poisson Jean-François , Chem. Eur. J., Volume 21, Number 10, p.3876–3881, (2015)

Theoretical Study, Synthesis, and Reactivity of Five-Membered-Ring Acyl Sulfonium Cations., Rao, K V. Raghaven, Caiveau Nicolas, David Rolf, Shalayel Ibrahim, Milet Anne, and Vallee Yannick. , Eur. J. Org. Chem., Volume 2015, Number 28, p.6125–6129, (2015)

Was methionine the molecular trigger of life on early earth?., Vallee, Yannick., Milet Anne, and Rao K V. Raghaven , Phosphorus, Sulfur Silicon Relat. Elem., Volume 191, Number 2, p.329–332, (2016)

At the very beginning of life on Earth: the thiol-rich peptide (TRP) world hypothesis., Vallee, Yannick., Shalayel Ibrahim, Ly Kieu-Dung, Rao K V. Raghaven, De Paepe Gael, Marker Katharina, and Milet Anne , Int. J. Develop. Biol., Volume 61, p.471–478, (2017)

Experimental bond dissociation energies of benzylpyridinium thermometer ions determined by threshold-CID and RRKM modeling., Gatineau, David, Memboeuf Antony, Milet Anne, Cole Richard B., Dossmann Heloise, Gimbert Yves, and Lesage Denis. , Int. J. Mass Spectrom., Volume 417, p.69–75, (2017)

Iron hydroperoxide intermediate in superoxide reductase: Protonation or dissociation first? MM dynamics and QM/MM metadynamics study., David, Rolf, Jamet Hélène, Niviere Vincent, Moreau Yohann, and Milet Anne , J. Chem. Theory Comput., Volume 13, Number 6, p.2987–3004, (2017)

Bond dissociation energies of carbonyl gold complexes: a new descriptor of ligand effects in gold(I) complexes?, Gatineau, David, Lesage Denis, Clavier Herve, Dossmann Heloise, Chan Chen H., Milet Anne, Memboeuf Antony, Cole Richard B., and Gimbert Yves , Dalton Trans., Volume 47, p.15497–15505, (2018)

The Reaction of Aminonitriles with Aminothiols: A Way to Thiol-Containing Peptides and Nitrogen Heterocycles in the Primitive Earth Ocean, Shalayel, Ibrahim, Coulibaly Seydou, Ly Kieu Dung, Milet Anne, and Vallee Yannick. , Life, Volume 8, Issue 4, (2018)

First Direct Evidence of an ortho-Lithiated Aryloxetane: Solid and Solution Structure, and Dynamics, Perna, Filippo M., Falcicchio Aurelia, Salomone Antonio, Milet Anne, Rizzi Rosanna, Hamdoun Ghanem, Barozzino‐Consiglio Gabriella, Stalke Dietmar, Oulyadi Hassan, and Capriati Vito , European Journal of Organic Chemistry, Volume 2019, p.5549–5556, (2019)

Interfacial Water at Graphene Oxide Surface: Ordered or Disordered?, Don, Visal Subasinghe, David Rolf, Du Pu, Milet Anne, and Kumar Revati , The Journal of Physical Chemistry B, Volume 123, p.1636–1649, (2019)

Ion Pairing in HCl-Water Clusters: From Electronic Structure Investigations to Multiconfigurational Force-Field Development, Bresnahan, Caitlin G., David Rolf, Milet Anne, and Kumar Revati , The Journal of Physical Chemistry A, (2019)

Mechanistic Perspectives in the Regioselective Indole Addition to Unsymmetrical Silyloxyallyl Cations, Bresnahan, Caitlin G., Taylor-Edinbyrd Kiara A., Cleveland Alexander H., Malone Joshua A., Dange Nitin S., Milet Anne, Kumar Revati, and Kartika Rendy , The Journal of Organic Chemistry, (2019)

DFT and TDDFT Study of 4-((Furan-2-Ylmethyl)Sulfonyl)-Substituted ZINC(II) Phthalocyanine: Importance of Grimme Dispersion with A Becke–Johnson Damping Correction and the Substituent Effect, Khazri, M., Sahra K., Milet Anne, Jamoussi B., and Messaoudi S. , Journal of Structural Chemistry, Volume 61, p.844–851, (2020)

A way to thioacetate esters compatible with non-oxidative prebiotic conditions, Leqraa, Naoual, Nicolet Yvain, Milet Anne, and Vallee Yannick. , Scientific Reports, Volume 10, p.14488, (2020)

Crossing of the Cystic Barriers of Toxoplasma gondii by the Fluorescent Coumarin Tetra-Cyclopeptide, Dard, Céline, Leforestier Baptiste, Hilário Flaviane Francisco, Traoré Mohamed Dit Mady, Lespinasse Marie-Ange, Peres Basile, Molina Marie-Carmen, de Freitas Rossimiriam Pereira, Milet Anne, Maubon Danièle, et al. , Molecules, Volume 26, (2021)