Projects per year
Personal profile
Areas of expertise
Awards
Diplomas
Areas of expertise
Awards
Diplomas
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
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Collaborations and top research areas from the last five years
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Kinetic Monte Carlo modelling of interlocked catenane formation
Datta, A. (PI), Das, A. (Researcher) & Leherte, L. (Researcher)
19/03/21 → …
Project: Research
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Multiresolution topological and non-covalent interaction analyses of electron density maps
Leherte, L. (PI)
1/03/20 → …
Project: Research
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Study of lipase structures through MD simulations
Labar, G. (PI), Wouters, J. (PI) & Leherte, L. (PI)
22/02/19 → …
Project: Research
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Multiresolution analysis of molecular electrostatic potentials for proteins
Leherte, L. (Researcher)
21/01/08 → …
Project: Research
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Molecular Dynamics simulations of energetic, structural, and dynamical properties of proteins in micellar medium
Leherte, L. (Researcher), Michaux, C. (Researcher) & Vercauteren, D. (CoI)
1/10/07 → …
Project: Research
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Guest exchange in a biomimetic ZnII cavity-complex: kinetic control by a catalytic water, through pore selection, 2nd sphere assistance, and induced-fit processes
Nyssen, N., Giraud, N., Wouters, J., Jabin, I., Leherte, L. & Reinaud, O., 9 Aug 2023, In: Inorganic Chemistry Frontiers. 10, 19, p. 5772-5781 10 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile3 Downloads (Pure) -
Human indoleamine-2,3-dioxygenase 2 cofactor lability and low substrate affinity explained by homology modeling, molecular dynamics and molecular docking
Mirgaux, M., Leherte, L. & Wouters, J., 2023, In: Journal of Biomolecular Structure & Dynamics. 42, 9, p. 4475-4488 14 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile48 Downloads (Pure) -
Description of Non-Covalent Interactions in Benzyl Chalcocyanate Crystals from Smoothed Cromer-Mann Electron Density Distribution Functions
Leherte, L., Bodart, L., Wouters, J. & Vercauteren, D., 7 Dec 2022, In: Journal of physics. Condensed matter. 34, 49, 494003.Research output: Contribution to journal › Article › peer-review
Open AccessFile4 Downloads (Pure) -
Correction to: Multiresolution non-covalent interaction analysis for ligand–protein promolecular electron density distributions (Theoretical Chemistry Accounts, (2021), 140, 1, (9), 10.1007/s00214-020-02705-w)
Leherte, L., Jul 2021, In: Theoretical Chemistry Accounts. 140, 7, 88.Research output: Contribution to journal › Comment/debate › peer-review
Open Access -
Molecular Mechanism for the Self-supported Synthesis of Graphitic Carbon Nitride from Urea Pyrolysis
Mukhopadhyay, T. K., Leherte, L. & Datta, A., 11 Feb 2021, In: The Journal of Physical Chemistry Letters. 12, 5, p. 1396-1406 11 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile137 Downloads (Pure)
Prizes
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Bourse de recherche scientifique de l'OTAN
Leherte, L. (Recipient), 1 Apr 1993
Prize: Fellowship awarded competitively
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Financement FSR "Simulations de propriétés structurales, énergétiques et dynamiques d'assemblages supramoléculaires constitués de cycloextrines"
Leherte, L. (Recipient), 2001
Prize: Other distinction
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FNRS subvention for "10th Europen Conference on Computational Chemistry"
Leherte, L. (Recipient), Aug 2015
Prize: Other distinction
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Prix du concours annuel (Groupe III - Chimie) de la Classe des Sciences
Leherte, L. (Recipient), 2009
Prize: Fellowship awarded competitively
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Prix du mémoire de fin d'études
Leherte, L. (Recipient), Jun 1986
Prize: Fellowship awarded competitively
Activities
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Molecules (Journal)
Leherte, L. (Peer reviewer)
1 Oct 2024Activity: Publication peer-review and editorial work types › Publication peer-review
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Journal of Molecular Graphics and Modelling (Journal)
Leherte, L. (Peer reviewer)
24 Aug 2024Activity: Publication peer-review and editorial work types › Publication peer-review
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9th EuChemS Chemistry Congress
Leherte, L. (Speaker)
7 Jul 2024 → 11 Jul 2024Activity: Talk or presentation types › Oral presentation
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Erasmus+ Course "Small molecule and protein crystallography and drug design"
Leherte, L. (Speaker)
3 Jun 2024 → 7 Jun 2024Activity: Participating in or organising an event types › Participation in workshop, seminar, course
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Ecole de Formation Interdisciplinaire Doctorale (EFID 2024)
Leherte, L. (Organiser)
24 May 2024Activity: Participating in or organising an event types › Participation in workshop, seminar, course
Thesis
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Simulations du comportement de molécules en interaction avec un réseau zéolithique
Leherte, L. (Author)ANDRE, J.-M. (Supervisor), 1990Student thesis: Doc types › Doctor of Sciences
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