Claude Lecomte

Overview

Best Publications

• Hydrogen bond strengths revealed by topological analyses of experimentally observed electron densities

  E Espinosa;E Espinosa;E Molins;C Lecomte

  3848
  Citations

• Topological analysis of the electron density in hydrogen bonds.

  E. Espinosa;M. Souhassou;H. Lachekar;C. Lecomte

  495
  Citations

• The nature of halogen...halogen interactions: a model derived from experimental charge-density analysis.

  Thai Thanh Thu Bui;Slimane Dahaoui;Claude Lecomte;Gautam R. Desiraju

  424
  Citations

• Advances in protein and small-molecule charge-density refinement methods using MoPro

  Christian Jelsch;Benoit Guillot;Angelique Lagoutte;Claude Lecomte

  394
  Citations

• Accurate protein crystallography at ultra-high resolution: valence electron distribution in crambin.

  Christian Jelsch;Martha M. Teeter;Victor Lamzin;Virginie Pichon-Pesme

  319
  Citations

• Experimental electron density overlapping in hydrogen bonds: topology vs. energetics

  E Espinosa;C Lecomte;E Molins

  291
  Citations

• Conformations and coordination schemes of carboxylate and carbamoyl derivatives of the tetraazamacrocycles cyclen and cyclam, and the relation to their protonation states

  M. Meyer;V. Dahaoui-Gindrey;Claude Lecomte;Roger Guilard

  266
  Citations

• On Building a Data Bank of Transferable Experimental Electron Density Parameters Applicable to Polypeptides

  V. Pichon-Pesme;C. Lecomte;H. Lachekar

  249
  Citations

• Oriented Mesoporous Silica Films Obtained by Electro-Assisted Self-Assembly (EASA)

  Aurélie Goux;Mathieu Etienne;Emmanuel Aubert;Claude Lecomte

  232
  Citations

• Structural Basis for Natural Lactonase and Promiscuous Phosphotriesterase Activities.

  Mikael Elias;Jérôme Dupuy;Luigia Merone;Luigi Mandrich

  205
  Citations

• Refinement of proteins at subatomic resolution with MOPRO

  Benoit Guillot;Laurence Viry;Regis Guillot;Claude Lecomte

  202
  Citations

• Transferability of Multipole Charge-Density Parameters: Application to Very High Resolution Oligopeptide and Protein Structures

  Christian Jelsch;Virginie Pichon-Pesme;Claude Lecomte;André Aubry

  194
  Citations

• On the application of an experimental multipolar pseudo-atom library for accurate refinement of small-molecule and protein crystal structures.

  Bartosz Zarychta;Bartosz Zarychta;Virginie Pichon-Pesme;Benoît Guillot;Claude Lecomte

  191
  Citations

• Peroxotitanium(IV) porphyrins. Synthesis, stereochemistry, and properties

  Roger Guilard;Jean Marc Latour;Claude Lecomte;Jean Claude Marchon

  158
  Citations

• Structure cristalline et configuration relative d'un complexe du titanocene presentant une chiralite plane et une chiralite centree sur l'atome de titane

  C. Lecomte;Y. Dusausoy;J. Protas;J. Tirouflet

  145
  Citations

• New Synthesis of trans-Disubstituted Cyclam Macrocycles – Elucidation of the Disubstitution Mechanism on the Basis of X-ray Data and Molecular Modeling

  Guy Royal;Valérie Dahaoui-Gindrey;Slimane Dahaoui;Alain Tabard

  143
  Citations

• Electrostatic complementarity in an aldose reductase complex from ultra-high-resolution crystallography and first-principles calculations

  Nicolas Muzet;Benoît Guillot;Christian Jelsch;Eduardo Ignacio Howard

  141
  Citations

• Single crystal diffraction analysis of the thermal spin conversion in [Fe(btr) $\mathsf{_{2}}$ (NCS) $\mathsf{_{2}}$ ](H $\mathsf{_{2}}$ O): evidence for spin-like domain formation

  S. Pillet;J. Hubsch;C. Lecomte

  124
  Citations

• Magnetostructural Relationship in the Spin-Crossover Complex t-{Fe(abpt)2[N(CN)2]2}: Polymorphism and Disorder Phenomenon

  Chou-Fu Sheu;Sébastien Pillet;Yen-Chen Lin;Szu-Miao Chen

  123
  Citations

• The crystal structure of a low-silica dehydrated NaX zeolite

  Florence Porcher;Mohamed Souhassou;Yves Dusausoy;Claude Lecomte

  121
  Citations