Systematic Investigation of Lipophilicity Modulation by Aliphatic Fluorination Motifs by Jeffries, Benjamin, Wang, Zhong, Felstead, Hannah R, Le Questel, Jean-Yves, Scott, James S, Chiarparin, Elisabetta, Graton, Jérôme, Linclau, Bruno

Get full text

Reducing the Lipophilicity of Perfluoroalkyl Groups by CF2–F/CF2–Me or CF3/CH3 Exchange by Jeffries, Benjamin, Wang, Zhong, Graton, Jérôme, Holland, Simon D, Brind, Thomasin, Greenwood, Ryan D. R, Le Questel, Jean-Yves, Scott, James S, Chiarparin, Elisabetta, Linclau, Bruno

Get full text

Experimental and computational evidence of halogen bonds involving astatine by Guo, Ning, Maurice, Rémi, Teze, David, Graton, Jérôme, Champion, Julie, Montavon, Gilles, Galland, Nicolas

Get full text

Synthesis of 2,3,4-Trideoxy-2,3,4-trifluoroglucose by Quiquempoix, Lucas, Wang, Zhong, Graton, Jérôme, Latchem, Peter G, Light, Mark, Le Questel, Jean-Yves, Linclau, Bruno

Get full text

Delocalized relativistic effects, from the viewpoint of halogen bonding by Sarr, Serigne, Graton, Jérôme, Rahali, Seyfeddine, Montavon, Gilles, Galland, Nicolas

Get full text

The Diiodine Basicity Scale: Toward a General Halogen-Bond Basicity Scale by Laurence, Christian, Graton, Jérôme, Berthelot, Michel, El Ghomari, Mohamed J.

Get full text

The pK(BHX) database: toward a better understanding of hydrogen-bond basicity for medicinal chemists by Laurence, Christian, Brameld, Ken A, Graton, Jérôme, Le Questel, Jean-Yves, Renault, Eric

Get full text

Characterization of Steroids through Collision Cross Sections: Contribution of Quantum Chemistry Calculations by Graton, Jérôme, Hernández-Mesa, Maykel, Normand, Samuel, Dervilly, Gaud, Le Questel, Jean-Yves, Le Bizec, Bruno

Get full text

Hydrogen-Bond Accepting Properties of New Heteroaromatic Ring Chemical Motifs: A Theoretical Study by Graton, Jérôme, Le Questel, Jean-Yves, Maxwell, Peter, Popelier, Paul

Get full text

Hydrogen-Bond Acidity of OH Groups in Various Molecular Environments (Phenols, Alcohols, Steroid Derivatives, and Amino Acids Structures): Experimental Measurements and Density Fun... by Graton, Jérôme, Besseau, François, Brossard, Anne-Marie, Charpentier, Eloïse, Deroche, Arnaud, Le Questel, Jean-Yves

Get full text

On the Interplay between Charge‐Shift Bonding and Halogen Bonding by Sarr, Serigne, Graton, Jérôme, Montavon, Gilles, Pilmé, Julien, Galland, Nicolas

Get full text

Antioxidant properties of catechin and its 3′O-α-glucoside: Insights from computational chemistry calculations by Graton, Jérôme, Goupille, Anaïs, Ferré, Tanguy, Offmann, Bernard, André-Miral, Corinne, Le Questel, Jean-Yves

Get full text

Towards a Stronger Halogen Bond Involving Astatine: Unexpected Adduct with Bu3PO Stabilized by Hydrogen Bonding by Liu, Lu, Guo, Ning, Champion, Julie, Graton, Jérôme, Montavon, Gilles, Galland, Nicolas, Maurice, Rémi

Get full text

Conformation and structural features of diuron and irgarol: Insights from quantum chemistry calculations by Bouchouireb, Zakaria, Sussarellu, Rossana, Stachowski-Haberkorn, Sabine, Graton, Jérôme, Le Questel, Jean-Yves

Get full text

Relating Conformational Equilibria to Conformer‐Specific Lipophilicities: New Opportunities in Drug Discovery by Linclau, Bruno, Wang, Zhong, Jeffries, Benjamin, Graton, Jérôme, Carbajo, Rodrigo J., Sinnaeve, Davy, Le Questel, Jean‐Yves, Scott, James S., Chiarparin, Elisabetta

Get full text

An Overview of Lewis Basicity and Affinity Scales by Laurence, Christian, Graton, Jérôme, Gal, Jean-François

Get full text

A regioselective C7 bromination and C7 palladium-catalyzed Suzuki-Miyaura cross-coupling arylation of 4-substituted NH-free indazoles by Boujdi, Khalid, El Brahmi, Nabil, Graton, Jérôme, Dubreuil, Didier, Collet, Sylvain, Mathé-Allainmat, Monique, Akssira, Mohamed, Lebreton, Jacques, El Kazzouli, Saïd

Get full text

The pKBHX Database: Toward a Better Understanding of Hydrogen-Bond Basicity for Medicinal Chemists by LAURENCE, Christian, BRAMELD, Ken A, GRATON, Jérôme, LE QUESTEL, Jean-Yves, RENAULT, Eric

Get full text

Can Quantum-Mechanical Calculations Yield Reasonable Estimates of Hydrogen-Bonding Acceptor Strength? The Case of Hydrogen-Bonded Complexes of Methanol by Koné, Mawa, Illien, Bertrand, Laurence, Christian, Graton, Jérôme

Get full text

Intramolecular OH center dot center dot center dot Fluorine Hydrogen Bonding in Saturated, Acyclic Fluorohydrins: The gamma-Fluoropropanol Motif by Linclau, Bruno, Peron, Florent, Bogdan, Elena, Wells, Neil, Wang, Zhong, Compain, Guillaume, Fontenelle, Clement Q., Galland, Nicolas, Le Questel, Jean-Yves, Graton, Jérôme

Get full text