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Pierre Fayon

Anionic silicate organic frameworks constructed from hexacoordinate silicon centres
2017 · Jérôme Roeser, Dragica Prill, et al. · Nature Chemistry · 165
Open-Source, Python-Based Redevelopment of the ChemShell Multiscale QM/MM Environment
2018 · You Lu, Matthew R. Farrow, et al. · Journal of Chemical Theory and Computation · 106
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A 3D Organically Synthesized Porous Carbon Material for Lithium‐Ion Batteries
2018 · Ziqiang Zhao, Saikat Das, et al. · Angewandte Chemie International Edition · 103
Structure–Thermodynamic‐Property Relationships in Cyanovinyl‐Based Microporous Polymer Networks for the Future Design of Advanced Carbon Capture Materials
2017 · Ali Yassin, Matthias Trunk, et al. · Advanced Functional Materials · 40
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Probing Enzymatic PET Degradation: Molecular Dynamics Analysis of Cutinase Adsorption and Stability
2024 · Mehdi Sahihi, Pierre Fayon, et al. · Journal of Chemical Information and Modeling · 24
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Formation mechanism of ultra porous framework materials
2016 · Pierre Fayon, Abbie Trewin · Physical Chemistry Chemical Physics · 20
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Structure and Properties of a Nanoporous Supercapacitor
2016 · P. Fayon, J. M. H. Thomas, et al. · The Journal of Physical Chemistry C · 16
Artificial Synthesis of Conjugated Microporous Polymers via Sonogashira–Hagihara Coupling
2020 · J.M.H. Thomas, C. Mollart, et al. · The Journal of Physical Chemistry B · 15
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Structure and dynamics of water in molecular models of hydrated polyvinylamine membranes
2019 · Pierre Fayon, Lev Sarkisov · Physical Chemistry Chemical Physics · 13
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A 3D Organically Synthesized Porous Carbon Material for Lithium‐Ion Batteries
2018 · Ziqiang Zhao, Saikat Das, et al. · Angewandte Chemie · 10
Graphene-based acceptor molecules for organic photovoltaic cells: a predictive study identifying high modularity and morphological stability
2016 · D. Bégué, E. Guille, et al. · RSC Advances · 10
Energetic and Structural Characterizations of the PET–Water Interface as a Key Step in Understanding Its Depolymerization
2023 · Pierre Fayon, Julien Devémy, et al. · The Journal of Physical Chemistry B · 9
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Electron and proton conducting framework organic salt single crystals
2022 · Chen Wang, Tingting Yan, et al. · Journal of Solid State Chemistry · 9
Interactions of insulin aspart hexamer and excipients with plasticized polyvinyl chloride surfaces: A comprehensive investigation combining molecular simulations and experiments
2025 · Pierre Fayon, Philip Chennell, et al. · International Journal of Biological Macromolecules · 4
A New Combined Computational and Experimental Approach to Characterize Photoactive Conjugated 3D Polymers
2025 · Catherine Mollart, Patrick Heasman, et al. · Small · 3
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Anhydrous Proton Conduction Through a Chemically Robust Electrolyte Enabling a High‐Temperature Non‐Precious Metal Catalyzed Fuel Cell
2023 · Junyan Zou, Yu Zhao, et al. · Small · 2
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Back Cover: A 3D Organically Synthesized Porous Carbon Material for Lithium‐Ion Batteries (Angew. Chem. Int. Ed. 37/2018)
2018 · Ziqiang Zhao, Saikat Das, et al. · Angewandte Chemie International Edition · 2
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Extensions of the siesta dft code for simulation of molecules
2013 · Coulaud, Olivier, Bordat, Patrice, et al. · arXiv (Cornell University) · 2
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Drug Delivery Mechanisms of Poly(glycerol sebacate): An In-Depth Study of the Energetics at the Molecular Scale
2025 · Xavier Davoy, Julien Devémy, et al. · Molecular Pharmaceutics · 1
Multi-Scale Modeling of Protein-Polymer Interactions: Insights into Biocompatibility and Drug Stability in Medical Applications
2025 · Sahihi, M., Saleh, A., et al. · HAL (Le Centre pour la Communication Scientifique Directe)
Partition coefficient for pharmaceutical applications: measurements and simulations.
2025 · Sarraute, S., Chennell, P., et al. · HAL (Le Centre pour la Communication Scientifique Directe)
Adsorption of protein and excipients onto polymer materials.
2024 · Fayon, P., Chennell, P., et al. · HAL (Le Centre pour la Communication Scientifique Directe)
Files for MD simulation of the interaction between LCC-ICCG cutinase and PET polymer
2023 · Patrice Malfreyt, Pierre Fayon, et al. · Zenodo (CERN European Organization for Nuclear Research)
A multi-scale modelling of an enzymatic PET degradation.
2023 · Sahihi, M., Fayon, P., et al. · HAL (Le Centre pour la Communication Scientifique Directe)
Modelling facilitated transport in Polyvinyl amine membranes for CO2 capture: insights from Molecular Dynamics and PC-SAFT EoS.
2019 · Riccardo Rea, Pierre Fayon, et al.
Works count: 34
Citation count: 554
H-index: 10
I10-index: 11
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