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Understanding the Reactivity and Tunability of MOF-Supported Cluster Catalysts and MOF Nodes towards Alkane Partial Oxidation Using Density Functional Theory
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Dynamic Urethane and Urethane-like Chemistries in Reprocessable Polymer Networks: Structure, Property, and Sustainability
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Multi-Scale, Multi-Class Agent-Based Models of Biological Systems
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Computational Modeling of Metal–Organic Frameworks for the Catalytic Hydrolysis of Nerve Agents and Their Simulants
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Interfacial and Confinement Effects in Polymer and Polymer Nanocomposites in Absence of Free Surfaces
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Improving and engineering cell-free systems for glycoprotein production
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Mixing and segregation of granular flows in a 3D tumbler
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Nonstoichiometric Perovskite Oxides for Solar-Driven Thermochemical Water Splitting
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Design and Optimization of a Field-Deployable Biosensing Platform for Measuring Water Quality
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Engineering the 1,2-Propanediol Utilization Bacterial Microcompartment to Develop a Tunable Nanobioreactor
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Engineering DNA-Based Materials for the Analysis of Live Single Cells
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Design of Engineered Ribosomes for Synthetic Biology
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Quantum-Chemical Screening of Redox-Active Metal–Organic Frameworks
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Investigating the Structure of Molybdenum Oxides and Sulfides for Catalytic Dehydrogenation
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Adsorption in Metal-Organic Frameworks for Energy Applications
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Engineering Protein Scaffolds as Programmable Cancer Therapeutics
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Identifying Support Effects in Nanoparticle Catalysis
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Modeling, Analysis, and Control of Heterogeneous Multicellular Oscillators
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Light Hydrocarbon Adsorption and Oligomerization in Acidic and Ni-Acid Zeolites
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Computational Modeling of Polymerization and Degradation of Complex Polymer Systems
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