Research Output 1966 2020

2016

Hybrid alginate-silica beads and method for obtaining them

Desmet, J., Meunier, C. & Su, B-L., 26 May 2016, IPC No. A61K 36/ 05 A I, Patent No. US2016143857, Priority date 17 Jun 2014, Priority No. WO2014EP62765

Research output: Patent

Silicon Dioxide
Patents and inventions
alginic acid
6 Downloads (Pure)
Molecules
Acids
Heat treatment
Dialysis
Cell death
Induction heating
Nickel
Surface treatment
Diazonium Compounds
Oxides

Investigating the first hyperpolarizability of liquid carbon tetrachloride

Cardenuto, M. H., Castet, F. & Champagne, B., 2016, In : RSC Advances. 6, 101, p. 99558-99563 6 p.

Research output: Contribution to journalArticle

Carbon tetrachloride
Carbon Tetrachloride
Liquids
Molecules
Hamiltonians

Kinetic and Thermodynamic Stabilization of Metal Complexes by Introverted Coordination in a Calix[6]azacryptand

Inthasot, A., Brunetti, E., Lejeune, M., Menard, N., Prangé, T., Fusaro, L., Bruylants, G., Reinaud, O., Luhmer, M., Jabin, I. & Colasson, B., 24 Mar 2016, In : Chemistry: A European Journal. 22, 14, p. 4855-4862 8 p.

Research output: Contribution to journalArticle

Coordination Complexes
Metal complexes
Stabilization
Ligands
Thermodynamics

Les systèmes sémiotiques en chimie: établissement d'une taxonomie et analyse langagière d'un programme de sciences et de manuels scolaires (grades 7 et 8)

Dehon, J. & Snauwaert, P., 2016, Actes des 9èmes rencontres scientifiques de l'Ardist . p. 79-84 5 p.

Research output: Contribution in Book/Catalog/Report/Conference proceedingConference contribution

Open Access
Photonics
Color
Liquids
Ethanol
Water

L’expérience d’une collaboration fructueuse et pérenne entre la Belgique et la Tunisie dans le district minier de Nefza-Sejnane

Yans, J., Ben Abdallah, R., Decree, S., Chargui, H., Dekoninck, A., Moussi, B., Dupuis, C., Chaftar, H-R., Vandeneede, V., Hajjaji, W., Pilate, P., HATIRA, N., Baele, J. M., Wouters, J. & Jamoussi, F., 7 Apr 2016, Ressources and Innovative Geology 2016 - Abstract book.

Research output: Contribution in Book/Catalog/Report/Conference proceedingConference contribution

Mechanistic Insight into Heptosyltransferase Inhibition by using Kdo Multivalent Glycoclusters

Tikad, A., Fu, H., Sevrain, C. M., Laurent, S., Nierengarten, J. F. & Vincent, S. P., 5 Sep 2016, In : Chemistry: A European Journal. 22, 37, p. 13147-13155 9 p.

Research output: Contribution to journalArticle

Glycosyltransferases
Scaffolds
Fullerenes
Ligands
Porphyrins
Trifluoroacetic Acid
Mannose
Libraries
Oxidation
Scaffolds
Opioid Receptors
Molecular dynamics
Atoms
spatial resolution
molecular dynamics

New insights into the synthesis and biological activity of the pamamycin macrodiolides

Hanquet, G., Salom-Roig, X. & Lanners, S., 1 Feb 2016, In : Chimia. 70, 1-2, p. 20-28 9 p.

Research output: Contribution to journalReview article

Biosynthesis
Bioactivity
pamamycin
17 Downloads (Pure)

Nonlinear optical properties in open-shell molecular systems

Nakano, M. & Champagne, B., 1 Mar 2016, In : Wiley Interdisciplinary Reviews: Computational Molecular Science. 6, 2, p. 198-210 13 p.

Research output: Contribution to journalArticle

Open Access
File
Optical Devices
Optical Properties
Shell
Optical properties
optical properties

One-world chemistry and systems thinking

Matlin, S., Mehta, G., Hopf, H. & Krief, A., 2 May 2016, In : Nature Chemistry. 8, p. 393-398

Research output: Contribution to journalComment/debate

Sustainable development

Origin of the Enhancement of the Second Hyperpolarizabilities of Metal-Carbon Bonds

Takamuku, S., Kitagawa, Y., Nagami, T., Fujiyoshi, J. Y., Champagne, B. & Nakano, M., 1 Sep 2016, In : Journal of physical chemistry A. 120, 34, p. 6838-6848 11 p.

Research output: Contribution to journalArticle

Charge transfer
Carbon
Metals
charge transfer
Bond length
1 Downloads (Pure)

Oxazines: A New Class Of Second-Order Nonlinear Optical Switches

Beaujean, P., Bondu, F., Plaquet, A., Garcia-Amoros, J., Cusido, J., Raymo, F. M., Castet, F., Rodriguez, V. & Champagne, B., 20 Mar 2016, In : J. Am. Chem. Soc.. 138, p. 5052-62 11 p.

Research output: Contribution to journalArticle

Open Access
Oxazines
Optical switches
Excitation energy
Nitrophenols
Bearings (structural)
38 Downloads (Pure)
Open Access
File
Polystyrenes
Palladium
Resins
Gases
Metals

Parameterization of the ReaxFF Reactive Force Field for a Proline-Catalyzed Aldol Reaction

Hubin, P., Jacquemin, D., Leherte, L. & Vercauteren, D. P., 4 Sep 2016, In : Journal of Computational Chemistry. 37, 29, p. 2564-2572 9 p.

Research output: Contribution to journalArticle

Force Field
Parameterization
Simulated annealing
Set theory
Proline

Peculiar Case of Levetiracetam and Etiracetam α-Ketoglutaric Acid Cocrystals: Obtaining a Stable Conglomerate of Etiracetam

George, F., Norberg, B., Robeyns, K., Wouters, J. & Leyssens, T., 7 Sep 2016, In : Crystal Growth and Design. 16, 9, p. 5273-5282 10 p.

Research output: Contribution to journalArticle

etiracetam
Ketoglutaric Acids
Enantiomers
enantiomers
tautomers

pH Dependence of Photoinduced Electron Transfer with [Ru(TAP)3]2+

Troian-Gautier, L., Mugeniwabagara, E., Fusaro, L., Moucheron, C., Kirsch-De Mesmaeker, A. & Luhmer, M., 8 Nov 2016, In : Inorganic Chemistry.

Research output: Contribution to journalArticle

Excited states
Guanosine Monophosphate
guanosines
Quenching
electron transfer

Pillar[5]arene-Based Glycoclusters: Synthesis and Multivalent Binding to Pathogenic Bacterial Lectins

Buffet, K., Nierengarten, I., Galanos, N., Gillon, E., Holler, M., Imberty, A., Matthews, S. E., Vidal, S., Vincent, S. P. & Nierengarten, J. F., 24 Feb 2016, In : Chemistry (Weinheim an der Bergstrasse, Germany). 22, 9, p. 2955-2963 9 p.

Research output: Contribution to journalArticle

Lectins
Burkholderia
Alkynes
Pathogens
Carbohydrates
Dicarboxylic Acids
dicarboxylic acids
Tuning
tuning
solid state

Porous TiO2 urchins for high performance Li-ion battery electrode: Facile synthesis, characterization and structural evolution

Cai, Y., Wang, H. E., Huang, S. Z., Yuen, M. F., Cai, H. H., Wang, C., Yu, Y., Li, Y., Zhang, W. J. & Su, B. L., 20 Aug 2016, In : Electrochimica Acta. 210, p. 206-214 9 p.

Research output: Contribution to journalArticle

Lithium
Electrolytes
Electrodes
Calcination
Titanium dioxide

Potent Glycosidase Inhibition with Heterovalent Fullerenes: Unveiling the Binding Modes Triggering Multivalent Inhibition

Abellán Flos, M., García Moreno, M. I., Ortiz Mellet, C., García Fernández, J. M., Nierengarten, J. F. & Vincent, S. P., 2016, In : Chemistry: A European Journal. 22, 32, p. 11450-11460 11 p.

Research output: Contribution to journalArticle

Fullerenes
Enzyme inhibition
Glycoside Hydrolases
Enzymes
Binding sites

Probing effective photocorrosion inhibition and highly improved photocatalytic hydrogen production on monodisperse PANI@CdS core-shell nanospheres

Wang, C., Wang, L., Jin, J., Liu, J., Li, Y., Wu, M., Chen, L., Wang, B., Yang, X. & Su, B. L., 5 Jul 2016, In : Applied Catalysis B: Environmental. 188, p. 351-359 9 p.

Research output: Contribution to journalArticle

Cadmium sulfide
Nanospheres
Polyaniline
Hydrogen production
cadmium
Salts
salts
catalysts
Catalysts
Water
Molecular crystals
Quantum theory
quantum theory
Tensors
tensors
53 Downloads (Pure)

Reduced point charge models of proteins: Assessment based on molecular dynamics simulations

Leherte, L., 2016, In : Molecular Simulation. 42, 4, p. 289-304 16 p.

Research output: Contribution to journalArticle

Open Access
File
Molecular Dynamics Simulation
Molecular dynamics
Charge
molecular dynamics
proteins

Reinvestigation of the Branimycin Stereochemistry at Position 17-C

Čikoš, A., Triballeau, N., Hubbard, P. A., Žiher, D., Stouten, P. F. W., Doyon, J. G. P. O., Deschrijver, T., Wouters, J., Lépine, R. H. M. & Saniere, L., 19 Feb 2016, In : Organic Letters. 18, 4, p. 780-783 4 p.

Research output: Contribution to journalArticle

Stereochemistry
stereochemistry
Molecular modeling
X ray crystallography
X Ray Crystallography

Robust and Biocompatible Hybrid Matrix with Controllable Permeability for Microalgae Encapsulation

Zhang, B. B., Wang, L., Charles, V., Rooke, J. & Su, B. L., 27 Apr 2016, In : ACS Applied Materials and Interfaces. 8, 14, p. 8939-8946 8 p.

Research output: Contribution to journalArticle

Encapsulation
Silicon Dioxide
Silica
Alginate
Metabolites

Second-order nonlinear optical responses of heptahelicene and heptathiahelicene derivatives

Champagne, B. & Labidi, S. N., 16 Jan 2016, In : Chemical Physics Letters. 644, p. 195-200 6 p.

Research output: Contribution to journalArticle

Thiophenes
thiophenes
Benzene
Derivatives
rings
Cadmium
embedding
cadmium
Electrostatics
Metals

Self-assembly of polyhedral oligosilsesquioxane (POSS) into hierarchically ordered mesoporous carbons with uniform microporosity and nitrogen-doping for high performance supercapacitors

Liu, D., Cheng, G., Zhao, H., Zeng, C., Qu, D., Xiao, L., Tang, H., Deng, Z., Li, Y. & Su, B. L., 1 Apr 2016, In : Nano Energy. 22, p. 255-268 14 p.

Research output: Contribution to journalArticle

Microporosity
Self assembly
Nitrogen
Carbon
Doping (additives)
28 Downloads (Pure)
Open Access
File
Nucleosomes
DNA Methylation
Histones
Epigenomics
Histone Code

Supported C60-IL-PdNPs as extremely active nanocatalysts for C-C cross-coupling reactions

Giacalone, F., Campisciano, V., Calabrese, C., La Parola, V., Liotta, L. F., Aprile, C. & Gruttadauria, M., 2016, In : Journal of Materials Chemistry A. 4, 43, p. 17193-17206 14 p.

Research output: Contribution to journalArticle

Ionic Liquids
Palladium
Ionic liquids
Silicon Dioxide
Silica

Supramolecular Wiring of Benzo-1,3-chalcogenazoles through Programmed Chalcogen Bonding Interactions

Kremer, A., Fermi, A., Biot, N., Wouters, J. & Bonifazi, D., 11 Apr 2016, In : Chemistry (Weinheim an der Bergstrasse, Germany). 22, 16, p. 5665-5675 11 p.

Research output: Contribution to journalArticle

Chalcogens
Electric wiring
Nitrogen
Cyclization
Surface potential

Sustainable Approach to Waste-Minimized Sonogashira Cross-Coupling Reaction Based on Recoverable/Reusable Heterogeneous Catalytic/Base System and Acetonitrile Azeotrope

Kozell, V., McLaughlin, M., Strappaveccia, G., Santoro, S., Bivona, L. A., Aprile, C., Gruttadauria, M. & Vaccaro, L., 5 Dec 2016, In : ACS Sustainable Chemistry and Engineering. 4, 12, p. 7209-7216 8 p.

Research output: Contribution to journalArticle

Azeotropes
palladium
Palladium
Acetonitrile
catalyst
Photocatalysts
Electrons
electron
Nanoparticles
recombination
Factor XIIa
Coumarins
Structure-Activity Relationship
Enzyme Precursors
Blood Coagulation
10 Downloads (Pure)

Synthesis and Crystallographic Characterization of a Maleimide Derivative of Tryptamine

Dubois, J., Colaço, M., Rondelet, G. & Wouters, J., 21 Nov 2016, In : Crystals. 6, 8 p.

Research output: Contribution to journalArticle

Open Access
File
tryptamines
Maleic Anhydrides
Pyrroles
Crystallography
Maleic anhydride
2 Downloads (Pure)

Synthesis of 2-Ureido-4-ferrocenyl Pyrimidine Guests. Investigation of Complementary Molecular Recognition of 2,6-Diaminopyridine

Fehér, C., Papp, M., Gömöry, Á., Nagy, L., Wouters, J., Lendvay, G. & Skoda-Földes, R., 2016, In : Organometallics. 35, 24, p. 4023-4032 10 p.

Research output: Contribution to journalArticle

Molecular recognition
pyrimidines
Hydrogen bonds
hydrogen bonds
nuclear magnetic resonance

Synthesis of giant globular multivalent glycofullerenes as potent inhibitors in a model of Ebola virus infection

Muñoz, A., Sigwalt, D., Illescas, B. M., Luczkowiak, J., Rodríguez-Pérez, L., Nierengarten, I., Holler, M., Remy, J. S., Buffet, K., Vincent, S., Rojo, J., Delgado, R., Nierengarten, J. F. & Martín, N., 1 Jan 2016, In : Nature Chemistry. 8, 1, p. 50-57 8 p.

Research output: Contribution to journalArticle

Carbohydrates
Fullerenes
Viruses
Antiviral agents
Mitogen Receptors

Synthetic, Optical and Theoretical Study of Alternating Ethylenedioxythiophene–Pyridine Oligomers: Evolution from Planar Conjugated to Helicoidal Structure towards a Chiral Configuration

Chevallier, F., Charlot, M., Mongin, F., Champagne, B., Franz, E., Clays, K. & Blanchard-Desce, M., 15 Dec 2016, In : ChemPhysChem. 17, 24, p. 4090-4101 12 p.

Research output: Contribution to journalArticle

oligomers
Oligomers
Electrons
Chromophores
configurations

Targeting an Aromatic Hotspot in Plasmodium falciparum 1-Deoxy-d-xylulose-5-phosphate Reductoisomerase with β-Arylpropyl Analogues of Fosmidomycin

Sooriyaarachchi, S., Chofor, R., Risseeuw, M. D. P., Bergfors, T., Pouyez, J., Dowd, C. S., Maes, L., Wouters, J., Jones, T. A., Van Calenbergh, S. & Mowbray, S. L., 20 Sep 2016, In : ChemMedChem. p. 2024-2036 13 p.

Research output: Contribution to journalArticle

Plasmodium falciparum
Polyisoprenyl Phosphates
Enzymes
Plasmodium
Biosynthesis

The Ishango Bone: Symbol of humankind’s intellectual progress from the heart of Africa

Matlin, S., Krief, A. & Lambin, P., Jan 2016, Science*Policy*Africa : Newsletter of the African Academy of Sciences, 10, 4, p. 10-11.

Research output: Contribution to specialist publicationArticle

hydrogen
configuration interaction
tuning
ground state
approximation
15 Downloads (Pure)

The role of fluids in high-pressure polymorphism of drugs: Different behaviour of β-chlorpropamide in different inert gas and liquid media

Zakharov, B. A., Seryotkin, Y. V., Tumanov, N. A., Paliwoda, D., Hanfland, M., Kurnosov, A. V. & Boldyreva, E. V., 28 Sep 2016, In : RSC Advances. 6, 95, p. 92629-92637 9 p.

Research output: Contribution to journalArticle

File
Chlorpropamide
Noble Gases
Inert gases
Polymorphism
Fluids