المؤلفون: Antonio Cardinale, Alessandro Castrogiovanni, Theophile Gaudin, Joppe Geluykens, Teodoro Laino, Matteo Manica, Daniel Probst, Philippe Schwaller, Aleksandros Sobczyk, Alessandra Toniato, Alain C. Vaucher, Heiko Wolf, Federico Zipoli

المصدر: CHIMIA, Vol 77, Iss 7/8 (2023)

مصطلحات موضوعية: Digital chemistry, Language models, Machine learning, Sandmeyer Award 2022, Synthetic Organic Chemistry, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://www.chimia.ch/chimia/article/view/7032; https://doaj.org/toc/0009-4293; https://doaj.org/toc/2673-2424

URL الوصول: https://doaj.org/article/a7d5d4b484f54709884821f7a8e58eba

المؤلفون: Alessandra Toniato, Oliver Schilter, Teodoro Laino

المصدر: CHIMIA, Vol 77, Iss 3 (2023)

مصطلحات موضوعية: Artificial intelligence, Chemical Industry, LCA, Sustainability, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://chimia.ch/chimia/article/view/6265; https://doaj.org/toc/0009-4293; https://doaj.org/toc/2673-2424

URL الوصول: https://doaj.org/article/5d354490b7d2403aae9d74e75eb1eabe

المؤلفون: Miruna T Cretu, Alessandra Toniato, Amol Thakkar, Amin A Debabeche, Teodoro Laino, Alain C Vaucher

المصدر: Machine Learning: Science and Technology, Vol 4, Iss 3, p 035014 (2023)

مصطلحات موضوعية: chemoinformatics, molecule standardization, molecular transformer, compound representation, natural language processing, chemical datasets, Computer engineering. Computer hardware, TK7885-7895, Electronic computers. Computer science, QA75.5-76.95

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2632-2153

URL الوصول: https://doaj.org/article/940a57d4fb2c4fa6b80bc83dd1673912

المؤلفون: Alessandra Toniato (10058518)

مصطلحات موضوعية: Organic Chemistry, Knowledge Representation and Machine Learning, Synthesis of Materials, Organic Chemical Synthesis, AI, Chemistry, Noise, chemical datasets, Machine Learning, NLP, Organic synthesis, Retrsynthesis planning, Datasets curation

Relation: https://figshare.com/articles/journal_contribution/Source_Data/13674496

الاتاحة: https://doi.org/10.6084/m9.figshare.13674496.v2

المؤلفون: Alessandra Toniato, Alain C. Vaucher, Philippe Schwaller, Teodoro Laino

المصدر: Digital Discovery. 2:489-501

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::88f38384833a3cdc0b2a7d2479c19698
https://doi.org/10.1039/d2dd00110a

المؤلفون: Alessandra Toniato (8911352), Philippe Schwaller (5928596), Antonio Cardinale (8911445), Joppe Geluykens (8178659), Teodoro Laino (5929183)

مصطلحات موضوعية: Organic Synthesis and Reactions, Machine Learning, Artificial Intelligence, Chemoinformatics - Computational Chemistry, Artificial Intelligence research, Organic Syntheses, machine learning-based, data-driven research, noise-reduction, data curation strategy

Relation: https://figshare.com/articles/preprint/Unassisted_Noise-Reduction_of_Chemical_Reactions_Data_Sets/12395120

الاتاحة: https://doi.org/10.26434/chemrxiv.12395120.v2

المؤلفون: Miruna T. Cretu, Alessandra Toniato, Amol Thakkar, Amin Debabeche, Teodoro Laino, Alain C. Vaucher

Relation: https://doi.org/10.26434/chemrxiv-2022-14ztf-v2; https://github.com/rxn4chemistry/rxn-standardization; https://zenodo.org/communities/rxn4chemistry; https://doi.org/10.5281/zenodo.7842043; https://doi.org/10.5281/zenodo.7842044; oai:zenodo.org:7842044

الاتاحة: https://doi.org/10.5281/zenodo.7842044

المؤلفون: Teodoro Laino, Alessandra Toniato, Alain C. Vaucher

المصدر: Catalysis Today. 387:140-142

مصطلحات موضوعية: Chemical process, Computer science, Emerging technologies, General Chemistry, Data science, Catalysis, Grand Challenges, Pace

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::e3238c399835445c10e0928a9a2cc373
https://doi.org/10.1016/j.cattod.2021.10.001

المؤلفون: Miruna T. Cretu, Alessandra Toniato, Alain C. Vaucher, Amol Thakkar, Amin Debabeche, Teodoro Laino

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::ce598e2198359818f62129926a8bfc7f
https://doi.org/10.26434/chemrxiv-2022-14ztf

المؤلفون: Alessandra Toniato, Jan P. Unsleber, Alain C. Vaucher, Thomas Weymuth, Daniel Probst, Teodoro Laino, Markus Reiher

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bc5048a192d5378e151e41595967af88
https://doi.org/10.26434/chemrxiv-2022-gd0q9

المؤلفون: Amol Thakkar, Alain Vaucher, Andrea Byekwaso, Philippe Schwaller, Alessandra Toniato, Teodoro Laino

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::d38554e86b39350d76a68c37a22d77e5
https://doi.org/10.26434/chemrxiv-2022-gx9gb

المؤلفون: Alessandra Toniato, Joppe Geluykens, Teodoro Laino, Philippe Schwaller, Antonio Cardinale

المصدر: Nature Machine Intelligence. 3:485-494

مصطلحات موضوعية: 0301 basic medicine, Computer Networks and Communications, Computer science, Noise reduction, media_common.quotation_subject, Machine learning, computer.software_genre, 03 medical and health sciences, 0302 clinical medicine, Artificial Intelligence, Quality (business), Divergence (statistics), media_common, Artificial neural network, business.industry, Deep learning, Class (biology), Human-Computer Interaction, 030104 developmental biology, Metric (mathematics), Computer Vision and Pattern Recognition, Artificial intelligence, business, computer, 030217 neurology & neurosurgery, Software, Predictive modelling

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::02db1cf948560170132531e7c1666c9b
https://doi.org/10.1038/s42256-021-00319-w

المؤلفون: Andrea Byekwaso, Alain C. Vaucher, Philippe Schwaller, Alessandra Toniato, Teodoro Laino

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::08b86520e129ba3baff51ac14c966589
https://doi.org/10.26434/chemrxiv-2021-7hp1s

المؤلفون: Alessandra Toniato, Philippe Schwaller, Antonio Cardinale, Joppe Geluykens, Teodoro Laino

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4970881d7f42c9c37fbdb6b5fe1acb57
https://doi.org/10.26434/chemrxiv.12395120

المؤلفون: Alessandra Toniato, Antonio Cardinale, Teodoro Laino, Philippe Schwaller

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::036e4592b31b17ba0168f2da4cc2c57b
https://doi.org/10.1021/scimeetings.0c06955

المؤلفون: Alessandra Toniato

Relation: https://zenodo.org/communities/rxn4chemistry; https://doi.org/10.5281/zenodo.5242941; https://doi.org/10.5281/zenodo.5242942; oai:zenodo.org:5242942

الاتاحة: https://doi.org/10.5281/zenodo.5242942