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1

Quantification of “fuzzy” chemical concepts: a computational perspective

Gonthier, Jérôme F., Steinmann, Stephan N., Wodrich, Matthew D., Corminboeuf, Clémence

Journal:

Chemical Society Reviews

Année:

2012

Langue:

english

Fichier:

PDF, 4.00 MB

english, 2012

2

Structure Activity Relationship, Drug Metabolism and Pharmacokinetics Properties Optimization and In Vivo Studies of New Brain Penetrant Triple T-Type Calcium Channel Blockers

Siegrist, Romain, Pozzi, Davide, Jacob, Gaël, Torrisi, Caterina, Colas, Kilian, Braibant, Bertrand, Mawet, Jacques, Pfeifer, Thomas, de Kanter, Ruben, Roch, Catherine, Kessler, Melanie, Corminboeuf, O

Journal:

Journal of Medicinal Chemistry

Année:

2016

Langue:

english

Fichier:

PDF, 1011 KB

english, 2016

3

Calibration of the Absolute Linearity of Lock-In Amplifiers

Corminboeuf, David

Journal:

IEEE Transactions on Instrumentation and Measurement

Année:

2018

Langue:

english

Fichier:

PDF, 2.10 MB

english, 2018

4

H2O2 Generation by Decamethylferrocene at a Liquid|Liquid Interface

Bin Su, Raheleh Partovi Nia, Fei Li, Mohamad Hojeij, Michel Prudent, Clémence Corminboeuf, Zdenek Samec, Hubert H. Girault

Journal:

Angewandte Chemie

Année:

2008

Langue:

english

Fichier:

PDF, 475 KB

english, 2008

5

Why are the Interaction Energies of Charge-Transfer Complexes Challenging for DFT?

Steinmann, Stephan N., Piemontesi, Cyril, Delachat, Aurore, Corminboeuf, Clemence

Journal:

Journal of Chemical Theory and Computation

Année:

2012

Langue:

english

Fichier:

PDF, 3.25 MB

english, 2012

6

Oxygen and proton reduction by decamethylferrocene in non-aqueous acidic media

Su, Bin, Hatay, Imren, Ge, Pei Yu, Mendez, Manuel, Corminboeuf, Clemence, Samec, Zdenek, Ersoz, Mustafa, Girault, Hubert H.

Journal:

Chemical Communications

Année:

2010

Langue:

english

Fichier:

PDF, 989 KB

english, 2010

7

The Magnetic Shielding Function of Molecules and Pi-Electron Delocalization

Heine, Thomas, Corminboeuf, Clémence, Seifert, Gotthard

Journal:

Chemical Reviews

Année:

2005

Langue:

english

Fichier:

PDF, 1.30 MB

english, 2005

8

Nucleus-Independent Chemical Shifts (NICS) as an Aromaticity Criterion

Chen, Zhongfang, Wannere, Chaitanya S., Corminboeuf, Clémence, Puchta, Ralph, Schleyer, Paul von Ragué

Journal:

Chemical Reviews

Année:

2005

Langue:

english

Fichier:

PDF, 2.00 MB

english, 2005

9

Oxygen Reduction Catalyzed by a Fluorinated Tetraphenylporphyrin Free Base at Liquid/Liquid Interfaces

Hatay, Imren, Su, Bin, Méndez, Manuel A., Corminboeuf, Clémence, Khoury, Tony, Gros, Claude P., Bourdillon, Mélanie, Meyer, Michel, Barbe, Jean-Michel, Ersoz, Mustafa, Záliš, Stanislav, Samec, Zde

Journal:

Journal of the American Chemical Society

Année:

2010

Langue:

english

Fichier:

PDF, 4.60 MB

english, 2010

10

How important is self-consistency for the dDsC density dependent dispersion correction?

Brémond, Éric, Golubev, Nikolay, Steinmann, Stephan N., Corminboeuf, Clémence

Journal:

The Journal of Chemical Physics

Année:

2014

Langue:

english

Fichier:

PDF, 1.42 MB

english, 2014

11

A generalized-gradient approximation exchange hole model for dispersion coefficients

Steinmann, Stephan N., Corminboeuf, Clemence

Journal:

The Journal of Chemical Physics

Année:

2011

Langue:

english

Fichier:

PDF, 494 KB

english, 2011

12

Charge transport in highly ordered organic nanofibrils: lessons from modelling

Gryn’ova, Ganna, Nicolaï, Adrien, Prlj, Antonio, Ollitrault, Pauline, Andrienko, Denis, Corminboeuf, Clemence

Journal:

Journal of Materials Chemistry C

Année:

2017

Langue:

english

Fichier:

PDF, 1.83 MB

english, 2017

13

Intramolecular symmetry-adapted perturbation theory with a single-determinant wavefunction

Pastorczak, Ewa, Prlj, Antonio, Gonthier, Jérôme F., Corminboeuf, Clémence

Journal:

The Journal of Chemical Physics

Année:

2015

Langue:

english

Fichier:

PDF, 1.71 MB

english, 2015

14

Fluorescence Quenching in BODIPY Dyes: The Role of Intramolecular Interactions and Charge Transfer

Prlj, Antonio, Vannay, Laurent, Corminboeuf, Clemence

Journal:

Helvetica Chimica Acta

Année:

2017

Langue:

english

Fichier:

PDF, 683 KB

english, 2017

15

How does alkyl chain length modify the properties of triphenylamine-based hole transport materials?

Lin, Kun-Han, Prlj, Antonio, Corminboeuf, Clemence

Journal:

Journal of Materials Chemistry C

Année:

2018

Langue:

english

Fichier:

PDF, 2.11 MB

english, 2018

16

Vous êtes dévot et vous vous emportez! L’effet d’attente déçue dans les constructions à valeur oppositive

Corminboeuf, Gilles

Journal:

The Canadian Journal of Linguistics / La revue canadienne de linguistique

Année:

2015

Fichier:

PDF, 1.04 MB

2015

17

Fine-tuned organic photoredox catalysts for fragmentation-alkynylation cascades of cyclic oxime ethers

Le Vaillant, Franck, Garreau, Marion, Nicolai, Stefano, Gryn'ova, Ganna, Corminboeuf, Clemence, Waser, Jerome

Journal:

Chemical Science

Année:

2018

Langue:

english

Fichier:

PDF, 986 KB

english, 2018

18

[IEEE 2018 Conference on Precision Electromagnetic Measurements (CPEM 2018) - Paris, France (2018.7.8-2018.7.13)] 2018 Conference on Precision Electromagnetic Measurements (CPEM 2018) - Calibration of the Absolute Linearity of Lock-in Amplifiers

Corminboeuf, David

Année:

2018

Langue:

english

Fichier:

PDF, 303 KB

english, 2018

19

Magnetische Abschirmtensoren der Protonen in Benzol – vom Einzelmolekül zum Kristall

Thomas Heine, Clémence Corminboeuf, Gisbert Grossmann, Ulrich Haeberlen

Journal:

Angewandte Chemie

Année:

2006

Langue:

german

Fichier:

PDF, 208 KB

german, 2006

20

Direct Assessment of Electron Delocalization Using NMR Chemical Shifts

Stephan N. Steinmann, Daniel F. Jana, Judy I.-C. Wu, Paul von R. Schleyer, Yirong Mo, Clémence Corminboeuf

Journal:

Angewandte Chemie

Année:

2009

Langue:

english

Fichier:

PDF, 806 KB

english, 2009

21

Proton Magnetic Shielding Tensors in Benzene—From the Individual Molecule to the Crystal

Thomas Heine, Clémence Corminboeuf, Gisbert Grossmann, Ulrich Haeberlen

Journal:

Angewandte Chemie International Edition

Année:

2006

Langue:

english

Fichier:

PDF, 205 KB

english, 2006

22

H2O2 Generation by Decamethylferrocene at a Liquid|Liquid Interface

Bin Su, Raheleh Partovi Nia, Fei Li, Mohamad Hojeij, Michel Prudent, Clémence Corminboeuf, Zdenek Samec, Hubert H. Girault

Journal:

Angewandte Chemie International Edition

Année:

2008

Langue:

english

Fichier:

PDF, 475 KB

english, 2008

23

Direct Assessment of Electron Delocalization Using NMR Chemical Shifts

Stephan N. Steinmann, Daniel F. Jana, Judy I.-C. Wu, Paul von R. Schleyer, Yirong Mo, Clémence Corminboeuf

Journal:

Angewandte Chemie International Edition

Année:

2009

Langue:

english

Fichier:

PDF, 806 KB

english, 2009

24

Chiral Relay: A Novel Strategy for the Control and Amplification of Enantioselectivity in Chiral Lewis Acid Promoted Reactions

Olivier Corminboeuf, Laura Quaranta, Philippe Renaud, Mei Liu, Craig P. Jasperse, Mukund P. Sibi

Journal:

Chemistry - A European Journal

Année:

2003

Langue:

english

Fichier:

PDF, 406 KB

english, 2003

25

A Computational Study of Radical Haloacetal Cyclizations Controlled by the Acetal Center

Olivier Corminboeuf, Philippe Renaud, Carl H. Schiesser

Journal:

Chemistry - A European Journal

Année:

2003

Langue:

english

Fichier:

PDF, 383 KB

english, 2003

26

Phosphoramidite Ligands in Iridium-Catalyzed Allylic Substitution

Damien Polet, Alexandre Alexakis, Karine Tissot-Croset, Clémence Corminboeuf, Klaus Ditrich

Journal:

Chemistry - A European Journal

Année:

2006

Langue:

english

Fichier:

PDF, 468 KB

english, 2006

27

Aromaticity of Tri- and Tetranuclear Metal–Carbonyl Clusters Based on Magnetic Criteria

Clémence Corminboeuf, Paul von Ragué Schleyer, R. Bruce King

Journal:

Chemistry - A European Journal

Année:

2007

Langue:

english

Fichier:

PDF, 558 KB

english, 2007

28

Double Aromaticity in Monocyclic Carbon, Boron, and Borocarbon Rings Based on Magnetic Criteria

Matthew D. Wodrich, Clémence Corminboeuf, Sung Soo Park, Paul von Ragué Schleyer

Journal:

Chemistry - A European Journal

Année:

2007

Langue:

english

Fichier:

PDF, 694 KB

english, 2007

29

ChemInform Abstract: Sulfoxides in Radical Chemistry. High 1,2-Asymmetric Induction in Radical Cyclizations.

Christoph Imboden, Thierry Bourquard, Olivier Corminboeuf, Philippe Renaud, Kurt Schenk, Mohamed Zahouily

Journal:

Année:

1999

Fichier:

PDF, 30 KB

1999

30

ChemInform Abstract: Chiral Relay Effect: 4-Substituted 1,3-Benzoxazol-2-(3H)-ones as Achiral Templates for Enantioselective Diels—Alder Reactions.

Laura Quaranta, Olivier Corminboeuf, Philippe Renaud

Journal:

Année:

2002

Langue:

english

Fichier:

PDF, 37 KB

english, 2002

31

Enantioselective Diels—Alder Reactions with N-Hydroxy-N-phenylacrylamide.

Olivier Corminboeuf, Philippe Renaud

Journal:

Année:

2002

Fichier:

PDF, 31 KB

2002

32

N-Alkoxyacrylamides as Substrates for Enantioselective Diels—Alder Reactions.

Olivier Corminboeuf, Philippe Renaud

Journal:

Année:

2002

Fichier:

PDF, 32 KB

2002

33

Chiral Relay: A Novel Strategy for the Control and Amplification of Enantioselectivity in Chiral Lewis Acid Promoted Reactions.

Olivier Corminboeuf, Laura Quaranta, Philippe Renaud, Mei Liu, Craig P. Jasperse, Mukund P. Sibi

Journal:

Année:

2003

Fichier:

PDF, 54 KB

2003

34

Enantioselective Total Synthesis of Briarellins E (I) and F (II): The First Total Syntheses of Briarellin Diterpenes.

Olivier Corminboeuf, Larry E. Overman, Lewis D. Pennington

Journal:

Année:

2003

Fichier:

PDF, 68 KB

2003

35

Antiaromaticity in Bare Deltahedral Silicon Clusters Satisfying Wade′s and Hirsch′s Rules: An Apparent Correlation of Antiaromaticity with High Symmetry.

R. Bruce King, Thomas Heine, Clemence Corminboeuf, Paul von Rague Schleyer

Journal:

Année:

2004

Fichier:

PDF, 52 KB

2004

36

Induced Magnetic Fields in Aromatic [n]-Annulenes — Interpretation of NICS Tensor Components

Clemence Corminboeuf, Thomas Heine, Gotthard Seifert, Paul von Rague Schleyer, Jacques Weber

Journal:

Année:

2004

Fichier:

PDF, 56 KB

2004

37

Evidence for d Orbital Aromaticity in Square Planar Coinage Metal Clusters.

Chaitanya S. Wannere, Clemence Corminboeuf, Zhi-Xiang Wang, Matthew D. Wodrich, R. Bruce King, Paul von Rague Schleyer

Journal:

Année:

2005

Fichier:

PDF, 9 KB

2005

38

The Magnetic Shielding Function of Molecules and Pi-Electron Delocalization

Thomas Heine, Clemence Corminboeuf, Gotthard Seifert

Journal:

Année:

2006

Fichier:

PDF, 8 KB

2006

39

Nucleus-Independent Chemical Shifts (NICS) as an Aromaticity Criterion

Zhongfang Chen, Chaitanya S. Wannere, Clemence Corminboeuf, Ralph Puchta, Paul von Rague Schleyer

Journal:

Année:

2006

Fichier:

PDF, 8 KB

2006

40

Achiral, Cheap, and Potent Inhibitors of Plasmepsins I, II, and IV

Christoph Boss, Olivier Corminboeuf, Corinna Grisostomi, Solange Meyer, Andrew F. Jones, Lars Prade, Christoph Binkert, Walter Fischli, Thomas Weller, Daniel Bur

Journal:

Année:

2006

Langue:

english

Fichier:

PDF, 384 KB

english, 2006

41

Implications of Molecular Orbital Symmetries and Energies for the Electron Delocalization of Inorganic Clusters

Clémence Corminboeuf, R. Bruce King, Paul von Rague Schleyer

Journal:

Année:

2007

Langue:

english

Fichier:

PDF, 387 KB

english, 2007

42

1,1′-Bi(trishomobarrelenyl) – Synthesis and Chiroptic Properties

Armin de Meijere, Karsten Rauch, Bernhard Schrader, Farina Brackmann, Roland Pfoh, Stephan Rühl, Yasunaka Katoh, Yoshio Okamoto, Matthew D. Wodrich, Clémence Corminboeuf, Peter R. Schreiner

Journal:

European Journal of Organic Chemistry

Année:

2009

Langue:

english

Fichier:

PDF, 207 KB

english, 2009

43

Efficiency of random search procedures along the silicon cluster series: Sin (n = 5–10, 15, and 20)

Fabrice Avaltroni, Clemence Corminboeuf

Journal:

Journal of Computational Chemistry

Année:

2011

Langue:

english

Fichier:

PDF, 579 KB

english, 2011

44

Identifying clusters as low-lying mimina—efficiency of stochastic and genetic algorithms using inexpensive electronic structure levels

Fabrice Avaltroni, Clemence Corminboeuf

Journal:

Journal of Computational Chemistry

Année:

2012

Langue:

english

Fichier:

PDF, 558 KB

english, 2012

45

Structure determination of slowly exchanging conformers in solution using high-resolution NMR, computational modeling and DFT-GIAO chemical shielding: application to an erythronolide A derivative

Dieter Muri, Clémence Corminboeuf, Erick M. Carreira, Damien Jeannerat

Journal:

Magnetic Resonance in Chemistry

Année:

2009

Langue:

english

Fichier:

PDF, 212 KB

english, 2009

46

Inhibitors of Plasmepsin II—potential antimalarial agents

Olivier Corminboeuf, Guillaume Dunet, Mehdi Hafsi, Julien Grimont, Corinna Grisostomi, Solange Meyer, Christoph Binkert, Daniel Bur, Andrew Jones, Lars Prade, Reto Brun, Christoph Boss

Journal:

Bioorganic & Medicinal Chemistry Letters

Année:

2006

Langue:

english

Fichier:

PDF, 194 KB

english, 2006

47

New classes of potent and bioavailable human renin inhibitors

L’uboš Remeň, Olivier Bezençon, Sylvia Richard-Bildstein, Daniel Bur, Lars Prade, Olivier Corminboeuf, Christoph Boss, Corinna Grisostomi, Thierry Sifferlen, Panja Strickner, Patrick Hess, Stéphane De

Journal:

Bioorganic & Medicinal Chemistry Letters

Année:

2009

Langue:

english

Fichier:

PDF, 546 KB

english, 2009

48

Piperidine-based renin inhibitors: Upper chain optimization

Olivier Corminboeuf, Olivier Bezençon, Ľuboš Remeň, Corinna Grisostomi, Sylvia Richard-Bildstein, Daniel Bur, Lars Prade, Panja Strickner, Patrick Hess, Walter Fischli, Beat Steiner, Alexander Treiber

Journal:

Bioorganic & Medicinal Chemistry Letters

Année:

2010

Langue:

english

Fichier:

PDF, 608 KB

english, 2010

49

Design and optimization of new piperidines as renin inhibitors

Olivier Corminboeuf, Olivier Bezençon, Corinna Grisostomi, Ľuboš Remeň, Sylvia Richard-Bildstein, Daniel Bur, Lars Prade, Patrick Hess, Panja Strickner, Walter Fischli, Beat Steiner, Alexander Treiber

Journal:

Bioorganic & Medicinal Chemistry Letters

Année:

2010

Langue:

english

Fichier:

PDF, 1.17 MB

english, 2010

50

Automatic detection of reaction start/endpoints in chemical and biotechnological reaction systems

Grégory Corminboeuf, Michael Amrhein, Olivier Naef

Journal:

Chemometrics and Intelligent Laboratory Systems

Année:

2007

Langue:

english

Fichier:

PDF, 1.84 MB

english, 2007