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Publications associées (39)

Editing Tetrasubstituted Carbon: Dual C–O Bond Functionalization of Tertiary Alcohols Enabled by Palladium-Based Dyotropic Rearrangement

Qian Wang, Jieping Zhu, Baochao Yang, Tristan Corentin Pierre Delcaillau

Many elegant asymmetric syntheses of enantioenriched tertiary alcohols have been developed, and both the transition metal-catalyzed and the radical-based peripheral functionalization of tertiary alcohols have attracted intensive research interest in recent ...

2024

Redox Properties of Flavin in BLUF and LOV Photoreceptor Proteins from Hybrid QM/MM Molecular Dynamics Simulation

Murat Kiliç

Flavins play an important role in many oxidation and reduction processes in biological systems. For example, flavin adenine dinucleotide (FAD) and flavin mononucleotide (FMN) are common cofactors found in enzymatic proteins that use the special redox prope ...

Amer Chemical Soc2024

Axial-Equatorial Halide Ordering in Layered Hybrid Perovskites from Isotropic-Anisotropic 207Pb NMR

David Lyndon Emsley, Michael Allan Hope, Ümmügülsüm Günes, Manuel Cordova, Aditya Mishra

Bandgap-tuneable mixed-halide 3D perovskites are of interest for multi-junction solar cells, but suffer from photoinduced spatial halide segregation. Mixed-halide 2D perovskites are more resistant to halide segregation and are promising coatings for 3D per ...

Weinheim2024

Advanced Interaction-aware Motion Models for Motorcycle Trajectory Prediction: Experiments on pNEUMA Datasets

Jingran Su

Forecasting the motion of motorcycles is a critical task for an autonomous system deployed in complex traffic, considering its distinguished characteristics compared to other vehicles. Motion of motorcycles in a scene is governed by the traffic context, i. ...

2023

Chiral control of spin-crossover dynamics in Fe (II) complexes

Majed Chergui, Malte Oppermann, Jérôme Lacour

Iron-based spin-crossover complexes hold tremendous promise as multifunctional switches in molecular devices. However, real-world technological applications require the excited high-spin state to be kinetically stable-a feature that has been achieved only ...

NATURE PORTFOLIO2022

Chirok: a post-refinement tool to analyse absolute structure

Philip Pattison

Chirok is software for a post-refinement test of the absolute structure. The software allows a user to calculate a distribution of the measure of chirality based on intensity quotients and linked to the Flack parameter. The distribution is fitted by a set ...

2020

Absolute Structure from Scanning Electron Microscopy

Philip Johannes Walter Moll

The absence of centrosymmetry in chiral and polar crystal structures is the reason for many technical relevant physical properties like optical birefringence or ferroelectricity. Other chirality related properties that are actually intensively investigated ...

2020

Vapour growth, morphology, absolute structure and pyroelectric coefficient of meta-nitroaniline single crystals

Dragan Damjanovic

The growth speed of (hkl) faces in the vapour phase, the absolute structure obtained by X-ray crystallography, and the value and the sign of the pyroelectric coefficient of meta-nitroaniline (mNA) were analysed in detail. The in situ observation of morpho ...

2019

Indole Alkaloids, Macrocycles and Heterocycles

Cyril Piemontesi

An enantioselective total synthesis of (-)-terengganensine A, a heptacyclic monoterpene indole alkaloid, was performed. A short sequence allowed to obtain the enantio-enriched target in good overall yield. The synthesis featured a key asymmetric transfer h ...

EPFL2018

Statistical mechanical model of gas adsorption in porous crystals with dynamic moieties

Berend Smit, Cory Matthew Simon, Efrem Daniel Braun

Some nanoporous, crystalline materials possess dynamic constituents, for example, rotatable moieties. These moieties can undergo a conformation change in response to the adsorption of guest molecules, which qualitatively impacts adsorption behavior. We pos ...

National Academy of Sciences2017

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