Projects per year
Fingerprint
Collaborations and top research areas from the last five years
Profiles
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Pierre Beaujean
- Namur Institute of Structured Matter
- Technological Platform High Performance Computing
- Unit of theoretical and structural physico-chemistry
Person: Assistant Scientific Staff, Scientific Staff researcher with a Term Contract
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Crystallization in capsules under microfluidic control for the fundamental study of nucleation processes
Wouters, J. & SCHEID, B.
1/01/24 → 31/12/27
Project: Research
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Structural and functional characterization of a copper efflux membrane protein : PcoB from Caulobacter crescentus
1/01/24 → 30/09/25
Project: Research
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Targeting the splicing factor TFIP11 in cancer by an intrinsically disordered protein-based drug design strategy
JUNIKU, B., Michaux, C. & Mottet, D.
1/01/24 → 30/09/25
Project: Research
Research output
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Design, physicochemical confirmation, single crystal structures as well as exploration of antibacterial and anticancer potential of organotin(IV) carboxylates
Gul, R., Muhammad, N., Sirajuddin, M., Noor, A., Tumanov, N., Wouters, J., Chafik, A., Solak, K., Mavi, A., Shujah, S., Ali, S., Khan, G. S. & Qayyum, S., 15 Mar 2024, In: Journal of molecular structure. 1300, 137306.Research output: Contribution to journal › Article › peer-review
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Disentangling the molecular polarizability and first hyperpolarizability of methanol–air interfaces
Ramos, T. N. & Champagne, B., 2024, In: Physical chemistry chemical physics : PCCP. 26, 11Research output: Contribution to journal › Article › peer-review
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Multimillion Atom Simulations of Di-8-ANEPPS Chromophores Embedded in a Model Plasma Membrane: Toward the Investigation of Realistic Dyed Cell Membranes
Bouquiaux, C., Champagne, B. & Beaujean, P., 22 Jan 2024, In: Journal of chemical information and modeling. 64, 2, p. 518-531 14 p.Research output: Contribution to journal › Article › peer-review
Activities
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NISM Annual Meeting 2023
Vincent Liegeois (Organiser)
18 Dec 2023Activity: Participating in or organising an event types › Participation in conference
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EFMC^2 Tandem Talks "Real World Use of FEP+ Calculations"
Laurence Leherte (Participant)
28 Nov 2023Activity: Participating in or organising an event types › Participation to a Symposium, a study Day
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2023 SRC Scientific Day: Photochemistry, a shining tool for scientists
Laurence Leherte (Member of Scientific Committee)
19 Oct 2023Activity: Participating in or organising an event types › Participation to a Symposium, a study Day
Prizes
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best oral communication award
MEINGUET, Celine (Recipient), 5 Jun 2013
Prize: Prize (including medals and awards)
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Bourse de recherche scientifique de l'OTAN
Leherte, Laurence (Recipient), 1 Apr 1993
Prize: Fellowship awarded competitively
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Press/Media
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Study Findings on Antimalarial Agents Are Outlined in Reports from University of Namur (Salt and Cocrystals Combining Sulfathiazole With Pyrimethamine)
Johan Wouters & Nikolay Tumanov
5/12/23
1 item of Media coverage
Press/Media: Expert Comment
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University of Namur Reports Findings in Chemical Physics (First hyperpolarizability of the di-8-ANEPPS and DR1 nonlinear optical chromophores in solution. An experimental and multi-scale theoretical chemistry study)
Benoît Champagne, Pierre Beaujean, Charlotte Bouquiaux & Tárcius N. Ramos
20/11/23
1 item of Media coverage
Press/Media: Expert Comment
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University of Namur Reports Findings in Science (Understanding the surrounding effects on Raman optical activity signatures of a chiral cage system: Cryptophane-PP-111)
Vincent Liégeois & Lou D'HAESE
10/11/23
1 item of Media coverage
Press/Media: Expert Comment
Datasets
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CCDC 1812258: Experimental Crystal Structure Determination
Casillas, R. (Contributor), Adam, M. (Contributor), Coto, P. B. (Contributor), Waterloo, A. R. (Contributor), Zirzlmeier, J. (Contributor), Reddy, S. R. (Contributor), Hampel, F. (Contributor), McDonald, R. (Contributor), Tykwinski, R. R. (Contributor), Thoss, M. (Contributor) & Guldi, D. M. (Creator), University of Namur, 10 Jan 2019
DOI: 10.5517/ccdc.csd.cc1ytsyh, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc1ytsyh&sid=DataCite
Dataset
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CCDC 1037381: Experimental Crystal Structure Determination
BONIFAZI, D. (Contributor), Bruylants, G. (Contributor), De Leo, F. (Contributor), Georgiou, I. (Contributor), Kervyn, S. (Contributor), ROSSIGNON, A. (Contributor) & Wouters, J. (Contributor), Cambridge Crystallographic Data Centre, 1 Jan 2017
DOI: 10.5517/ccdc.csd.cc13tgx9, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc13tgx9&sid=DataCite
Dataset
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CCDC 794450: Experimental Crystal Structure Determination
Dolušić, E. (Contributor), Larrieu, P. (Contributor), Blanc, S. (Contributor), Sapunaric, F. (Contributor), NORBERG, B. (Contributor), MOINEAUX, L. (Contributor), Colette, D. (Contributor), Stroobant, V. (Contributor), Pilotte, L. (Contributor), Colau, D. (Contributor), Ferain, T. (Contributor), Fraser, G. (Contributor), Galeni, M. (Contributor), Frere, J. (Contributor), Masereel, B. (Contributor), Benoit, V. D. E. (Contributor), Wouters, J. (Contributor) & Frederick, R. (Contributor), Cambridge Crystallographic Data Centre, 1 Jan 2011
DOI: 10.5517/ccvnpfl, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccvnpfl&sid=DataCite
Dataset
Student theses
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Analyse et modélisation de nouveaux inhibiteurs non nucléosidiques de la transcriptase inverse du virus de l'immunodéficience humaine de type 1 (VIH-1)
Author: Boland, S., 27 Feb 2004Supervisor: Durant, F. (Supervisor), Andre, J. (Jury), Hevesi, L. (Jury), Wouters, J. (Jury) & Burny, A. (External person) (Jury)
Student thesis: Doc types › Doctor of Sciences
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Apport de la chimie calculatoire à la modélisation de diagrammes de phases.
Author: Fontaine, M., 2003Supervisor: Andre, J. (Supervisor), Perpete, É. (Jury), Sporken, R. (Jury), ADJIMAN, C. (External person) (Jury) & Charlot, M. (External person) (Jury)
Student thesis: Doc types › Doctor of Sciences
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Approche structurale et fonctionnelle de la première enzyme de la voie de la sérine: PHGDH, une cible potentielle pour le traitement du cancer
Author: Themans, Q., 18 Oct 2019Supervisor: Wouters, J. (Supervisor), Leherte, L. (President), Unterlass, J. (External person) (Jury), Sirigu, S. (External person) (Jury) & Röhrig, U. F. (External person) (Jury)
Student thesis: Doc types › Doctor of Sciences
File