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782

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pt combined probes: pipeline, neutrino mass, and data compression

3 days ago by Alexander Reeves and others at ETH Zurich

Cosmology and Nongalactic Astrophysics, Astrophysics of Galaxies

Geometry and local environment of surface sites in Vanadium-based Ziegler-Natta catalysts from 51V solid-state NMR Spectroscopy

19 October 2023 by Sebastian Sabisch and others at ETH Zurich

Theoretical and Computational Chemistry, Inorganic Chemistry

Durable Light-Driven pH Switch for CO2 Capture/Release Enabled by Tuning Solvation Environment of Photoacids

17 October 2023 by Anna Vries and others at ETH Zurich

Physical Chemistry, Energy

Transformer Fusion with Optimal Transport

15 October 2023 by Moritz Imfeld and others at ETH Zurich

Machine Learning

Total Synthesis of Isoxeniolide A

9 October 2023 by Leo Betschart and Karl-heinz Altmann at ETH Zurich

Organic Chemistry, Natural Products

Quantification of inhomogeneous local proton density distributions in soft matter, unstructured macromolecules and non-Anfinsen biomacromolecules

9 October 2023 by Sergei Kuzin and others at ETH Zurich

Physical Chemistry, Biological and Medicinal Chemistry

Experimental and Theoretical Studies on the Reactions of Aliphatic Imines with Isocyanates

9 October 2023 by Etienne Cotter and others at ETH Zurich

Organic Chemistry, Organic Compounds and Functional Groups

Quantum Magnifying Glass for Chemistry at the Nanoscale

3 October 2023 by Katja-sophia Csizi and others at ETH Zurich

Theoretical and Computational Chemistry, Organic Chemistry

Metadynamics Simulations Reveal Alloying-Dealloying Processes During CO2 Hydrogenation with Bimetallic PdGa Nanoparticle Catalysts

29 September 2023 by Julian Baumgärtner and others at ETH Zurich

Theoretical and Computational Chemistry, Catalysis

Preface: A Data-driven Volumetric Prior for Few-shot Ultra High-resolution Face Synthesis

28 September 2023 by Marcel Bühler and others at ETH Zurich

Computer Vision and Pattern Recognition, Artificial Intelligence

Ultrafast computational screening of molecules with inverted singlet-triplet energy gaps using the Pariser-Parr-Pople semi-empirical quantum chemistry method

25 September 2023 by Kjell Jorner and others at ETH Zurich

Theoretical and Computational Chemistry, Physical Chemistry

Implications of Ga Promotion and Metal-Oxide Interfaces in Tailored Propane Dehydrogenation Catalysts Supported on Carbon

21 September 2023 by Enzo Brack and others at ETH Zurich

Catalysis, Nanoscience

Small Cobalt Nanoparticles Favor Reverse Water-Gas Shift Reaction over Methanation Under CO2 Hydrogenation Conditions

21 September 2023 by Xiaoyu Zhou and others at ETH Zurich

Inorganic Chemistry, Catalysis

Deep interactome learning for de novo drug design

19 September 2023 by Kenneth Atz and others at ETH Zurich

Theoretical and Computational Chemistry, Machine Learning

Grove: a Separation-Logic Library for Verifying Distributed Systems (Extended Version)

14 September 2023 by Upamanyu Sharma and others at

MIT

Logic in Computer Science, Distributed, Parallel, and Cluster Computing

Accelerating Alchemical Free Energy Prediction Using a Multistate Method: Application to Multiple Kinases

14 September 2023 by Candide Champion and others at ETH Zurich

Theoretical and Computational Chemistry, Computational Chemistry and Modeling

Well-Defined Ti Surface Sites in Ziegler-Natta Pre-Catalysts from 47/49Ti solid-state Nuclear Magnetic Resonance Spectroscopy

12 September 2023 by Alexander Yakimov and others at ETH Zurich

Theoretical and Computational Chemistry, Physical Chemistry

Anion Effect in Electrochemical CO2 Reduction: Enhanced Selectivity Enabled Through Anion Modulation

11 September 2023 by Ji Mun Yoo and Maria Lukatskaya at ETH Zurich

Catalysis, Energy

Molecularly defined lubricant hydrocarbons from olefin metathesis

8 September 2023 by Zachariah Berkson and others at ETH Zurich

Organic Chemistry, Catalysis

Active Sites in Cr(III)-based Ethylene Polymerization Catalysts from Machine Learning-Supported XAS and EPR Spectroscopy

8 September 2023 by Anton Ashuiev and others at ETH Zurich

Inorganic Chemistry, Polymers

Accelerated Exploration of Heterogeneous CO2 Hydrogenation Catalysts by Bayesian Optimized High-throughput and Automated Experimentation.

7 September 2023 by Adrian Ramirez and others at ETH Zurich

Inorganic Chemistry, Catalysis

Implications of Ga Promotion and Metal-Oxide Interfaces in Tailored Propane Dehydrogenation Catalysts Supported on Carbon

6 September 2023 by Enzo Brack and others at ETH Zurich

Catalysis, Nanoscience

An exact and ubiquitous condition for solid-state deracemization in vitro and in nature

5 September 2023 by Leif-thore Deck and others at ETH Zurich

Physical Chemistry, Chemical Engineering and Industrial Chemistry

Water-assisted generation of catalytic interface: The case of interfacial Pt-FeOx(OH)y sites active in preferential carbon monoxide oxidation

5 September 2023 by Ilia Sadykov and others at ETH Zurich

Physical Chemistry, Catalysis

Anion Effect in Electrochemical CO2 Reduction: Enhanced Selectivity Enabled Through Anion Modulation

4 September 2023 by Ji Mun Yoo and Maria Lukatskaya at ETH Zurich

Catalysis, Energy

SIMPD: an Algorithm for Generating Simulated Time Splits for Validating Machine Learning Approaches

4 September 2023 by Gregory Landrum and others at ETH Zurich

Theoretical and Computational Chemistry, Machine Learning

Geometry and local environment of surface sites in Vanadium-based Ziegler-Natta catalysts from 51V solid-state NMR Spectroscopy

31 August 2023 by Sebastian Sabisch and others at ETH Zurich

Theoretical and Computational Chemistry, Inorganic Chemistry

Tough Hydrogels for Load-Bearing Applications

29 August 2023 by Nika Petelinsek and Stefan Mommer at ETH Zurich

Materials Science, Polymer Science

Metadynamics Simulations Reveal Alloying-Dealloying Processes During CO2 Hydrogenation with Bimetallic PdGa Nanoparticle Catalysts

29 August 2023 by Julian Baumgärtner and others at ETH Zurich

Theoretical and Computational Chemistry, Catalysis

71Ga NMR Signatures of Lewis and Brønsted Acid Sites in Gallium Silicates Evidenced and Deciphered upon Interaction with Probe Molecules

21 August 2023 by Scott Docherty and others at ETH Zurich

Physical Chemistry, Inorganic Chemistry