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Genesys-Cat : automatic microkinetic model generation for heterogeneous catalysis with improved Bayesian optimization
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Ab initio group additive values for thermodynamic carbenium ion property prediction
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Steam cracking of methyl ester : a modeling study on the influence of the hydrocarbon backbone
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Combined catalytic and pyrolytic coking model for steam cracking of hydrocarbons
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Unravelling the influence of catalyst properties on light olefin production via Fischer-Tropsch synthesis : a descriptor space investigation using Single-Event MicroKinetics
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Mild temperature hydrothermal oxidation of anaerobic fermentation filtrate for carbon and nitrogen recovery in a regenerative life support system
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Micropollutant elimination by O3, UV and plasma-based AOPs : an evaluation of treatment and energy costs
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How chain length and branching influence the alkene cracking reactivity on H-ZSM-5
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Starmerella bombicola, an industrially relevant, yet fundamentally underexplored yeast
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Automated reaction database and reaction network analysis : extraction of reaction templates using cheminformatics