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Inorganic Chemistry

Molecular Models of Layered Ternary Cu2MoS4 Reveal Sulfur-Based H2 Evolution Pathway

Lauren T. Feden, Shatha Alabbad, Manuraj Kallumkal, Jan-Niklas Boyn, Gwendolyn Bailey

Organic Chemistry

Understanding fluoride exchange between aryl-trifluoroborates and aryl-trialkoxy silanes: access to benchtop aryl-aryl cross couplings.

Soroosh Saghebi, Tony Green, Uchechukwu Ariwodo, Matthew Minus

Theoretical and Computational Chemistry

Permutationally Invariant Fourier Series for Accurate and Robust Data-Driven Many-Body Potentials

Xuanyu Zhu, Francesco Paesani

Interaction of Li, Na and K overlayers with Pt(111): structure and fundamental properties

Andrey A. Koverga, Edson A. Ticianelli, Axel Groß

Dynamic changes in hydrogen evolution catalysis impose an upper bound on electrochemical hydrogen storage in Pd

Joseph Gauthier, Karsten Bruening, Kabian Ritter, David Tuckerman, Michael Hovish

Analytical Chemistry

Longitudinal plasma multi-omics characterization of nephrotoxicity in beagles after administration of propyl gallate enteric-coated tablets

Nathaly Reyes-Garcés, Weiwen Sun, B. Timothy Hummer, Xuejun Peng, Sebastian Vaca Jácome, Erica Forsberg, Matt Willetts, Anton I. Rosenbaum, Kévin Contrepois

Inorganic Chemistry

4f-Orbital Occupancy in Tetravalent Cerium Halide Complexes from X-ray Spectroscopy and Theory

Patrick Smith, Dumitru-Claudiu Sergentu, Jacob Branson, Dominic Russo, Corwin Booth, Jochen Autschbach, Stefan Minasian

Inorganic Chemistry

[Au(S-C6F5)] and [Au(S-C6F4-CF3)]: reactivity, structural, DSC, and calculations studies

Pavel Tkachenko, Alexander Maksimov, Varvara Lagunova, Veronica Sulyaeva, Denis Pishchur, Pavel Plyusnin, Alexey Berezin, Taisiya Sukhikh, Maxim Sokolov, Pavel Abramov

Synthesis and Evaluation Hydrogen-Bonding Organocatalysts Bearing P(V)-Stereogenic Centers

Zhen Wang, Mathias Christmann

Theoretical and Computational Chemistry

Finding Balance: Multi-Objective Optimization in Molecular Generative Modeling

Laura Landolfi, Bruno Catalanotti, Jon Paul Janet

Biological and Medicinal Chemistry

Trialblazer: A Chemistry-Focused Predictor of Toxicity Risks in Late-Stage Drug Development

Huanni Zhang, Matthias Welsch, William Schueller, Johannes Kirchmair

Chemical Engineering and Industrial Chemistry

Leveraging Data-driven Approach for Sand Production Prediction and Management in Oil and Gas Wells

Awwal Oladipupo, Isaac Johnson, Opeyemi Adebayo, Kingsley Abhulimen, Fashanu Theophilus

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