Rxn-INSIGHT: fast chemical reaction analysis using bond-electron matrices von Dobbelaere, Maarten R., Lengyel, István, Stevens, Christian V., Van Geem, Kevin M.

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Geometric deep learning for molecular property predictions with chemical accuracy across chemical space von Dobbelaere, Maarten R., Lengyel, István, Stevens, Christian V., Van Geem, Kevin M.

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Machine Learning in Chemical Engineering: Strengths, Weaknesses, Opportunities, and Threats von Dobbelaere, Maarten R., Plehiers, Pieter P., Van de Vijver, Ruben, Stevens, Christian V., Van Geem, Kevin M.

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Accelerated design of nickel-cobalt based catalysts for CO 2 hydrogenation with human-in-the-loop active machine learning von Kuddusi, Yasemen, Dobbelaere, Maarten R, Van Geem, Kevin M, Züttel, Andreas

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Accelerated design of nickel-cobalt based catalysts for CO2 hydrogenation with human-in-the-loop active machine learning von Kuddusi, Yasemen, Dobbelaere, Maarten R, Van Geem, Kevin M, Züttel, Andreas

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Learning Molecular Representations for Thermochemistry Prediction of Cyclic Hydrocarbons and Oxygenates von Dobbelaere, Maarten R, Plehiers, Pieter P, Van de Vijver, Ruben, Stevens, Christian V, Van Geem, Kevin M

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Active Machine Learning for Chemical Engineers: A Bright Future Lies Ahead von Ureel, Yannick, Dobbelaere, Maarten R., Ouyang, Yi, De Ras, Kevin, Sabbe, Maarten K., Marin, Guy B., Van Geem, Kevin M.

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Machine Learning for Physicochemical Property Prediction of Complex Hydrocarbon Mixtures von Dobbelaere, Maarten R., Ureel, Yannick, Vermeire, Florence H., Tomme, Lowie, Stevens, Christian V., Van Geem, Kevin M.

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Active learning-based exploration of the catalytic pyrolysis of plastic waste von Ureel, Yannick, Dobbelaere, Maarten R., Akin, Oğuzhan, Varghese, Robin John, Pernalete, César G., Thybaut, Joris W., Van Geem, Kevin M.

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Accelerated design of nickel-cobalt based catalysts for CO hydrogenation with human-in-the-loop active machine learning von Kuddusi, Yasemen, Dobbelaere, Maarten R, Van Geem, Kevin M, Züttel, Andreas

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Machine Learning for Physicochemical Property Prediction of Complex Hydrocarbon Mixtures von Dobbelaere, Maarten R, Ureel, Yannick, Vermeire, Florence H, Tomme, Lowie, Stevens, Christian, Van Geem, Kevin M

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Speeding up turbulent reactive flow simulation via a deep artificial neural network: A methodology study von Ouyang, Yi, Vandewalle, Laurien A., Chen, Lin, Plehiers, Pieter P., Dobbelaere, Maarten R., Heynderickx, Geraldine J., Marin, Guy B., Van Geem, Kevin M.

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Artificial Intelligence for Computer-Aided Synthesis In Flow: Analysis and Selection of Reaction Components von Plehiers, Pieter P., Coley, Connor W., Gao, Hanyu, Vermeire, Florence H., Dobbelaere, Maarten R., Stevens, Christian V., Van Geem, Kevin M., Green, William H.

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Additional file 2 of Rxn-INSIGHT: fast chemical reaction analysis using bond-electron matrices von Dobbelaere, Maarten R., Lengyel, István, Stevens, Christian V., Van Geem, Kevin M.

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Chemperium database for: Geometric Deep Learning for Molecular Property Predictions with Chemical Accuracy Across Chemical Space von Dobbelaere, Maarten R., Lengyel, Istvan, Stevens, Christian V., Van Geem, Kevin M.

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USPTO Dataset for: Fast Chemical Reaction Condition Suggestion via Rule-Based Classification and Similarity Search von Dobbelaere, Maarten R., Lengyel, Istvan, Stevens, Christian V., Van Geem, Kevin M.

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Bayesian tuned kinetic Monte Carlo modeling of polystyrene pyrolysis: Unraveling the pathways to its monomer, dimers, and trimers formation von Dogu, Onur, Eschenbacher, Andreas, John Varghese, Robin, Dobbelaere, Maarten, D'hooge, Dagmar R., Van Steenberge, Paul H.M., Van Geem, Kevin M.

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REQUITE: A prospective multicentre cohort study of patients undergoing radiotherapy for breast, lung or prostate cancer von Seibold, Petra, Webb, Adam, Aguado-Barrera, Miguel E, Azria, David, Bourgier, Celine, Brengues, Muriel, Briers, Erik, Bultijnck, Renee, Calvo-Crespo, Patricia, Carballo, Ana, Choudhury, Ananya, Cicchetti, Alessandro, Classen, Johannes, Delmastro, Elena, Dunning, Alison M, Elliott, Rebecca M, Fachal, Laura, Farcy-Jacquet, Marie-Pierre, Gabriele, Pietro, Garibaldi, Elisabetta, Gomez-Caamano, Antonio, Gutierrez-Enriquez, Sara, Higginson, Daniel S, Johnson, Kerstie, Lobato-Busto, Ramon, Molla, Meritxell, Mueller, Anusha, Payne, Debbie, Peleteiro, Paula, Post, Giselle, Rancati, Tiziana, Rattay, Tim, Reyes, Victoria, Rosenstein, Barry S, De Ruysscher, Dirk, De Santis, Maria Carmen, Schaefer, Joerg, Schnabel, Thomas, Sperk, Elena, Symonds, R. Paul, Stobart, Hilary, Taboada-Valladares, Begona, Talbot, Christopher J, Valdagni, Riccardo, Vega, Ana, Veldeman, Liv, Ward, Tim, Weissenberger, Christian, West, Catharine M.L, Chang-Claude, Jenny, Lievens, Yolande, van Eijkeren, Marc, Vandecasteele, Katrien, Elhamin, Elhaseen, Ost, Piet, Fonteyne, Valerie, Swimberghe, Martijn, Deseyne, Pieter, De Neve, Wilfried, Duprez, Frederic, Mareel, Marcus, Monten, Chris, Van Greveling, Annick, Vercauteren, Tom, Paelinck, Leen, Defraene, Gilles, Aerts, Rita, Arredouani, Soumia, Lambrecht, Maarten, Vanneste, Ben, Draghici, Roxana, Giordano, Frank, Herskind, Carsten, Veldwijk, Marlon, Helmbold, Irmgard, Giesche, Ulrich, Stegmaier, Petra, Weiss, Christian, Blaschke, Thomas, Neu, Burkhard, Lozza, Laura, Avuzzi, Barbara, Morlino, Sara, Sangalli, Claudia, Franceschini, Marzia, Rodriguez-Lage, Belina, Fernandez-Tajes, Juan, Fuentes-Rios, Olivia, Dominguez-Rios, Isabel, Fajardo-Paneque, Irene, Sosa-Fajardo, Paloma, Torrado-Moya, Laura, Ramos-Albiac, Monica, Giraldo, Alexandra, Altabas, Manolo, Pique-Leiva, Bibiana, Garcia-Relancio, David, Laver, Alejandro Seoane-Ramallo Samuel, Wright, Simon, Dobbelaere, Hannah

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