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63

Asymmetric stereodivergent catalysis achieved by means of a switchable asymmetric catalyst built on supramolecular helices

20 October 2023 by Ran Chen and others at Sorbonne University

Organic Chemistry, Catalysis

Tailored Functional Monolayers Made from Mesoionic Carbenes

10 October 2023 by Emmanuel Maisonhaute and others at Sorbonne University

Materials Chemistry

High-throughput large scale microfluidic assembly of iron oxide nanoflowers@PS-b-PAA polymeric micelles as multimodal nanoplatforms for photothermia and magnetic imaging

6 October 2023 by Emilia Benassai and others at Sorbonne University

Physical Chemistry

Capturing the interactions in the BaSnF4 ionic conductor: comparison between a machine-learning potential and a polarizable force field

18 September 2023 by Xiliang Lian and Mathieu Salanne at Sorbonne University

Theoretical and Computational Chemistry, Computational Chemistry and Modeling

Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF4

6 September 2023 by Briséïs Mercadier and others at Sorbonne University

Theoretical and Computational Chemistry, Inorganic Chemistry

Disclosing the interfacial electrolyte structure at Na-insertion electrode materials: origins of desolvation phenomenon

29 August 2023 by Kateryna Goloviznina and others at Sorbonne University

Theoretical and Computational Chemistry, Energy

A fluorogenic chemically induced dimerization technology for controlling, imaging and sensing protein proximity

28 August 2023 by Bottone, S. and others at Sorbonne University

Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF4

1 August 2023 by Briséïs Mercadier and others at Sorbonne University

Theoretical and Computational Chemistry, Inorganic Chemistry

Capturing the interactions in the BaSnF4 ionic conductor: comparison between a machine-learning potential and a polarizable force field

26 July 2023 by Xiliang Lian and Mathieu Salanne at Sorbonne University

Theoretical and Computational Chemistry, Computational Chemistry and Modeling

Vibrational circular dichroism spectroscopy with a classical polarizable force field: alanine in the gas and condensed phases

24 July 2023 by Jessica Bowles and others at Sorbonne University

Theoretical and Computational Chemistry

X-ray induced ultrafast charge transfer in thiophene-based conjugated polymers controlled by core-hole clock spectroscopy

21 July 2023 by Nicolas Velasquez and others at Sorbonne University

Theoretical and Computational Chemistry, Physical Chemistry

Environmental and Nuclear Quantum Effects on Double Proton Transfer in Guanine-Cytosine Base Pair

24 May 2023 by Federica Angiolari and others at Sorbonne University

Computational Chemistry and Modeling, Theory

Probing achiral benzene-1,3,5-tricarboxamide monomers as inducers of homochirality in supramolecular helical catalysts

20 April 2023 by Huanjun Kong and others at Sorbonne University

Supramolecular Chemistry, Catalysis

C3-Alkylation of Furfural Derivatives by Continuous Flow Homogeneous Catalysis

10 February 2023 by Gredy Kiala Kinkutu and others at Sorbonne University

Catalysis, Organic Chemistry

Calculation of the ELF in the excited state with single determinant methods

19 January 2023 by Andrea Echeverri and others at Sorbonne University

Structure, Theoretical and Computational Chemistry

On the key role of electrolyte-electrode van der Waals interactions in the simulation of ionic liquids-based supercapacitors

20 December 2022 by Camille Bacon and others at Sorbonne University

Theoretical and Computational Chemistry, Electrochemistry

Soft disorder modulates the assembly path of protein complexes

17 November 2022 by Seoane, B. and Carbone, A. at Sorbonne University

Nanostructural Organization in a Biredox Ionic Liquid

3 November 2022 by Roxanne Berthin and others at Sorbonne University

Theoretical and Computational Chemistry, Theory

Electrochemical Properties and Local Structure of the TEMPO/TEMPO+ Redox Pair in Ionic Liquids

17 October 2022 by Kateryna Goloviznina and Mathieu Salanne at Sorbonne University

Catalysis, Computational Chemistry and Modeling

Conformational preference analysis in C2H6 using Orbital Forces and Non-Covalent Interactions; comparison with related systems

12 October 2022 by Trinidad Novoa and others at Sorbonne University

Stereochemistry, Theoretical and Computational Chemistry

Inviting Trifluoromethylated Pseudoprolines into Collagen Model Peptides

1 September 2022 by Anaïs Terrien and others at Sorbonne University

Analytical Chemistry, Computational Chemistry and Modeling

Angular Orientation between the Cores of Magnetic Iron Oxide Nanoclusters Controls their Properties and Functions

2 August 2022 by Ali Abou-Hassan and others at Sorbonne University

Materials Science, Nanostructured Materials

Co-Ion Desorption as the Main Charging Mechanism in Metallic 1T-MoS2 Supercapacitors

25 July 2022 by Sheng Bi and Mathieu Salanne at Sorbonne University

Computational Chemistry and Modeling, Nanostructured Materials

Electron Transfer of Functionalised Quinones in Acetonitrile

13 June 2022 by Tzu-Yao Hsu and others at Sorbonne University

Electrochemistry, Physical Chemistry

Human CD4+/CD8α+ regulatory T cells induced by Faecalibacterium prausnitzii protect against intestinal inflammation

10 May 2022 by Touch, S. and others at Sorbonne University

Direct Synthesis of Mesoionic Carbene (MIC) Stabilized Gold Nanoparticles from 1,2,3-Triazolium Salts

19 April 2022 by Alexandre Porcheron and others at Sorbonne University

Coordination Chemistry, Organometallic Chemistry

C3–H Silylation of Furfural Derivatives: Direct Access to a Versatile Synthetic Platform Derived from Biomass

7 April 2022 by Sébastien Curpanen and others at Sorbonne University

Catalysis, Organometallic Chemistry

Dynamic Amino Acid Side-Chains Grafting on Folded Peptide Backbone

4 February 2022 by Benjamin Zagiel and others at Sorbonne University

Biological and Medicinal Chemistry, Chemical Biology

O(N) Stochastic Evaluation of Many-Body van der Waals Energies in Large Complex Systems

19 January 2022 by Pier Paolo Poier and others at Sorbonne University

Theory, Theoretical and Computational Chemistry

Effects of fluoride salt addition to the physico-chemical properties of the MgCl2-NaCl-KCl heat transfer fluid : a molecular dynamics study

18 January 2022 by Weiguang Zhou and others at Sorbonne University

Thermodynamics, Physical Chemistry

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