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TITLE: Active learning assists chemical intuition identify a scalable conversion of chitin to 3-acetamido-5-acetylfuran  Full Text
AUTHORS: Pereira, Juliana G.; Ravasco, Joao M. J. M.; Bustillo, Latimah; Marques, Ines S.; Kao, Po Yu; Li, Po Yi; Lin, Yen Chu; Rodrigues, Tiago; Bonifacio, Vasco D. B.; Andreia F. Peixoto ; Afonso, Carlos A. M.; Gomes, Rafael F. A.;
PUBLISHED: 2025, SOURCE: GREEN CHEMISTRY, VOLUME: 27, ISSUE: 6
INDEXED IN: Scopus WOS CrossRef
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TITLE: Stent Performance in the Spotlight: Simulation Using 3D-Printed Bifurcation Models  Full Text
AUTHORS: Oliveira, Catarina; Marques, Joao Silva; Rodrigues, Tiago; Menezes, Miguel Nobre; Santiago, Helena; Correia, Helena; Pinto, Fausto J.;
PUBLISHED: 2024, SOURCE: JOURNAL OF THE AMERICAN COLLEGE OF CARDIOLOGY, VOLUME: 84, ISSUE: 18
INDEXED IN: WOS
4
TITLE: A focus on the use of real-world datasets for yield prediction
AUTHORS: Bustillo, Latimah; Rodrigues, Tiago;
PUBLISHED: 2023, SOURCE: CHEMICAL SCIENCE, VOLUME: 14, ISSUE: 19
INDEXED IN: Scopus WOS
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TITLE: The rise of automated curiosity-driven discoveries in chemistry
AUTHORS: Bustillo, Latimah; Laino, Teodoro; Rodrigues, Tiago;
PUBLISHED: 2023, SOURCE: CHEMICAL SCIENCE, VOLUME: 14, ISSUE: 38
INDEXED IN: WOS
6
TITLE: Machine Learning Uncovers Natural Product Modulators of the 5-Lipoxygenase Pathway and Facilitates the Elucidation of Their Biological Mechanisms  Full Text
AUTHORS: Mikutis, Sigitas; Lawrinowitz, Stefanie; Kretzer, Christian; Dunsmore, Lavinia; Sketeris, Laurynas; Rodrigues, Tiago; Werz, Oliver; Bernardes, Goncalo J. L.;
PUBLISHED: 2023, SOURCE: ACS CHEMICAL BIOLOGY, VOLUME: 19, ISSUE: 1
INDEXED IN: Scopus WOS
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TITLE: <p>Comparison of 5 acute pulmonary embolism mortality risk scores in patients with COVID-19</p>
AUTHORS: Rodrigues, Tiago; Placido, Rui; Mendonca, Carlos; Rigueira, Joana; Almeida, Ana G.; Pinto, Fausto J. ; Silva, Beatriz Valente; Urbano, Maria Luisa;
PUBLISHED: 2022, SOURCE: IJC HEART & VASCULATURE, VOLUME: 39
INDEXED IN: WOS
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TITLE: Evaluation guidelines for machine learning tools in the chemical sciences
AUTHORS: Bender, Andreas; Schneider, Nadine; Segler, Marwin; Walters, W. Patrick; Engkvist, Ola; Rodrigues, Tiago;
PUBLISHED: 2022, SOURCE: NATURE REVIEWS CHEMISTRY, VOLUME: 6, ISSUE: 6
INDEXED IN: Scopus WOS
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TITLE: A special issue on artificial intelligence for drug discovery  Full Text
AUTHORS: Rodrigues, Tiago;
PUBLISHED: 2022, SOURCE: BIOORGANIC & MEDICINAL CHEMISTRY, VOLUME: 70
INDEXED IN: Scopus WOS
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TITLE: Combating small-molecule aggregation with machine learning
AUTHORS: Lee, K; Yang, A; Lin, YC; Reker, D; Bernardes, GJL; Rodrigues, T;
PUBLISHED: 2021, SOURCE: CELL REPORTS PHYSICAL SCIENCE, VOLUME: 2, ISSUE: 9
INDEXED IN: Scopus WOS
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