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Modulating Charges of Dual Sites in Multivariate Metal–Organic Frameworks for Boosting Selective Aerobic Epoxidation of Alkenes | Journal of the American Chemical Society
Toward Fast and Reliable Potential Energy Surfaces for Metallic Pt Clusters by Hierarchical Delta Neural Networks | Journal of Chemical Theory and Computation
Artificial Intelligence Enhanced Molecular Simulations | Journal of Chemical Theory and Computation
Theoretical Investigation of the Activity of Cobalt Oxides for the Electrochemical Oxidation of Water | Journal of the American Chemical Society
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Theoretical Investigation of the Activity of Cobalt Oxides for the Electrochemical Oxidation of Water | Journal of the American Chemical Society
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Electrochemical Activation of CO2 through Atomic Ordering Transformations of AuCu Nanoparticles | Journal of the American Chemical Society
Computational Methods in Heterogeneous Catalysis | Chemical Reviews
PDF) Low-Dose Slow Infusion Tissue Plasminogen Activator (tPA) in Treatment of Thrombotic Coronary Artery Occlusions: Case Series and Literature Review
Electrochemical Activation of CO2 through Atomic Ordering Transformations of AuCu Nanoparticles | Journal of the American Chemical Society
Transferable Machine Learning Interatomic Potential for Bond Dissociation Energy Prediction of Drug-like Molecules | Journal of Chemical Theory and Computation
Open-Source Machine Learning in Computational Chemistry | Journal of Chemical Information and Modeling
Anatomy in the metaverse: Exploring student technology acceptance through the UTAUT2 model - Kalınkara - Anatomical Sciences Education - Wiley Online Library
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Utilizing Wyckoff Sites to Construct Machine-Learning-Driven Interatomic Potentials for Crystalline Materials: A Case Study on α-Alumina | The Journal of Physical Chemistry C
Unraveling the Radiative Pathways of Hot Carriers upon Intense Photoexcitation of Lead Halide Perovskite Nanocrystals | ACS Nano
Anticancer Potential of Dendritic Poly(aryl ether)-Substituted Polypyridyl Ligand-Based Ruthenium(II) Coordination Entities | ACS Applied Bio Materials
Registry-Dependent Peeling of Layered Material Interfaces: The Case of Graphene Nanoribbons on Hexagonal Boron Nitride | ACS Applied Materials & Interfaces
Mixtures Recomposition by Neural Nets: A Multidisciplinary Overview | Journal of Chemical Information and Modeling
Transferable Machine Learning Interatomic Potential for Bond Dissociation Energy Prediction of Drug-like Molecules | Journal of Chemical Theory and Computation
Water | Free Full-Text | Towards a Cleaner Textile Industry: Using ASEC to Decrease the Water Footprint to Zero Liquid Discharge