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The approximate second order coupled-cluster method based on a size-consistent Brillouin-Wigner partitioning

Today by Linus Bjarne Dittmer and others at

Heidelberg University

Theoretical and Computational Chemistry, Physical Chemistry

Divergent polarity synthesis of glycosyl bicyclo[1.1.1]pentanes enabled by unified electrochemical difunctionalization of [1.1.1]propellane

Today by Jiandong Liu and others

Organic Chemistry

Spatiotemporally Resolved Mapping of Synaptic-to-Nuclear Signaling in Neurons via a Light-Free Tri-BRET Proximity Labeling System

Today by Afsaneh Taheri Kal-Koshvandi

Biological and Medicinal Chemistry, Organic Chemistry

Electrically Conducting Redox-Complementary Dual-Ligand 2D Graphitic MOF with Orthogonal Charge Transport Pathways

Today by Shiyu Zhang and others at

Clemson University

Organic Chemistry, Inorganic Chemistry

Photoredox Enabled Cobalt Catalyzed Enantioselective C–H Activation and APEX Reaction for C–N Axially Chiral Heterocycles

Today by Mainak Koner and others

Organic Chemistry, Catalysis

Auger-excited Photoluminescence from Gold Nanoflowers

Today by Wouter Koopman and others

Physical Chemistry, Materials Science

Construction of Sabatier Volcanoes for CO₂ Hydrogenation to C1-2 Oxygenates Using Data-Efficient Machine Learning

Today by Mikhail Polynski and Sergey Kozlov at

National University of Singapore

Theoretical and Computational Chemistry, Catalysis

The Effect of Impurities in Post-Consumer Plastic Waste on the Cracking of Polyolefins with Zeolite-based Catalysts

Today by Sebastian Rejman and others at

Utrecht University

Catalysis, Polymer Science

A molecular fragment database generated through simulated sequential single-bond-breaking

Today by Jesse Fraser and Arun Moorthy at

Trent University

Analytical Chemistry, Chemoinformatics

Conformational Trajectory of the Molecular Chameleon Grazoprevir from Formulation to Target-bound

Today by Lianne H. E. Wieske and others at

Uppsala University

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Unraveling the Dynamic Evolution of Cu-N-C during Electrochemical CO2 reduction: A Constant-Potential Ab-Initio Molecular Dynamics study

Today by Hyun Dong Jung and others at

Sogang University

Theoretical and Computational Chemistry, Materials Science

Kinetic Origins of Limited C-C coupling on Dual-Atom Catalysts in Electrochemical CO2 reduction

Today by Hyun Dong Jung and others at

Sogang University

Theoretical and Computational Chemistry, Materials Science

Macrocyclic Ruthenium Ring Expansion Metathesis Polymerization Initiators Exhibit Tether Length-Dependent Behavior

Today by Meredith Pomfret and others at

University of Washington

Organometallic Chemistry, Polymer Science

Polymerization From Lipid Membranes

Today by Alexandre Torzynski and others at

Materials Science, Polymer Science

Charge Regulation Effects in Weak Polyelectrolyte Complexation

Today by David Beyer and others

Polymer Science, Polyelectrolytes

mineMS2: Annotation of spectral libraries with exact fragmentation patterns

Today by Alexis Delabrière and others at

CEA Paris-Saclay

Theoretical and Computational Chemistry, Analytical Chemistry

Composites of Shellac and Silver Nanowires as Flexible, Biobased, and Corrosion-Resistant Transparent Conductive Electrodes

Today by Rahaf Hussein and others at

University of Windsor

Materials Science, Biodegradable Materials

AIMNet2-rxn: A Machine Learned Potential for Generalized Reaction Modeling on a Millions-of-Pathways Scale

Today by Dylan Anstine and others at

Michigan State University

Theoretical and Computational Chemistry, Physical Chemistry

NIR-II Imaging-Guided Self-Penetrating Nanomotors for Millimeter-Scale Deep Thrombolysis Tracking and Accelerated Embolus Clearance

Today by Meng Liu and others

Biological and Medicinal Chemistry, Nanoscience

Synthesis and Evaluation of Novel Oxanthrene Scaffold-derived Oxazolidinone Antibiotics with Potent Antitubercular Activity and Low Cellular Toxicity

Today by Kelsey Latterell and others

Biological and Medicinal Chemistry, Organic Chemistry

Photocatalytic Eosin Y Disproportionation as Driving Force for Terpene Cyclizations

Today by Thomas Rittner and others at

University of Regensburg

Theoretical and Computational Chemistry, Physical Chemistry

Quick assessment of a Small-Angle Scattering data using Guinier-Porod model: Introducing the correlative size

Today by Gustavo Quintero-Marquina and others

Physical Chemistry, Materials Science

The Role of Intrinsic Electric Fields and 2-His-1-Carboxylate/Chloride Facial Triads in Modulating Reactivity of the 2-Oxoglutarate Dependent Enzymes

Today by Wyatt Gibbs and Elvira Sayfutyarova at

Pennsylvania State University

Theoretical and Computational Chemistry, Physical Chemistry

Condensation of Forcefield parameters from Machine Learning predicted statistical distributions for High-Throughput Virtual screening applications

Today by Domenico Bonanni and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Decarboxylative Oxygenation Enabled by O–H Bond Selective Proton-Coupled Electron Transfer Ability of Photoexcited Nitroarenes

Today by Alana Duke and others at

New York University

Organic Chemistry, Organic Compounds and Functional Groups

Choline-Geranate (CAGE) Ionic Liquids Potentiate The Anticancer Activity Of Platinum-Based Drugs

Today by Marta Costa Verdugo and others

Biological and Medicinal Chemistry, Inorganic Chemistry

Capturing Local Compositional Fluctuations in NMR Modelling of Solid Solutions

Today by Ricardo Grau-Crespo and others at

Queen Mary University of London

Theoretical and Computational Chemistry, Physical Chemistry

Design and Synthesis of a Medium-pore Aluminosilicate Zeolite SCM-53

Today by Rui Li and others

Materials Science, Inorganic Chemistry

Exploration of fluorinated peptoid-based histone deacetylase inhibitors as dual-stage antiplasmodial agents

Today by Nina Reßing and others at

University of Bonn

Biological and Medicinal Chemistry

Enhancement of Complexation due to the Effect of a Bath: A van der Waals Complex in N2 Bath

Today by Amit Paul and Manju Yadav

Theoretical and Computational Chemistry

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