Teodoro Laino

Publication Activity (10 Years)

Years Active: 2023-2024
Publications (10 Years): 10

Top Topics

Reduced Graphene Oxide

Transition Metal

Machine Learning

Top Venues

Chemical science

Digital discovery

Chemistry of materials : a publication of the American Chemical Society

This page only lists publications with an associated author ORCID identifier.

Publications

Oliver Schilter, Daniel Pacheco Gutierrez, Linnea M Folkmann, Alessandro Castrogiovanni, Alberto García-Durán, Federico Zipoli, Loïc M Roch, Teodoro Laino
Combining Bayesian optimization and automation to simultaneously optimize reaction conditions and routes. Chemical science 15 (20) (2024)
Oliver Schilter, Daniel Pacheco Gutierrez, Linnea M Folkmann, Alessandro Castrogiovanni, Alberto García-Durán, Federico Zipoli, Loïc M Roch, Teodoro Laino
Combining Bayesian optimization and automation to simultaneously optimize reaction conditions and routes. Chemical science 15 (20) (2024)
Alessandra Toniato, Alain Claude Vaucher, Marzena Maria Lehmann, Torsten Luksch, Philippe Schwaller, Marco Stenta, Teodoro Laino
Fast Customization of Chemical Language Models to Out-of-Distribution Data Sets. Chemistry of materials : a publication of the American Chemical Society 35 (21) (2023)
Alessandra Toniato, Oliver Schilter, Teodoro Laino
The Role of AI in Driving the Sustainability of the Chemical Industry. Chimia 77 (3) (2023)
Latimah Bustillo, Teodoro Laino, Tiago Rodrigues
The rise of automated curiosity-driven discoveries in chemistry. Chemical science 14 (38) (2023)
Oliver Schilter, Alain Claude Vaucher, Philippe Schwaller, Teodoro Laino
Designing catalysts with deep generative models and computational data. A case study for Suzuki cross coupling reactions. Digital discovery 2 (3) (2023)
Amol Thakkar, Alain Claude Vaucher, Andrea Byekwaso, Philippe Schwaller, Alessandra Toniato, Teodoro Laino
Unbiasing Retrosynthesis Language Models with Disconnection Prompts. ACS central science 9 (7) (2023)
Manu Suvarna, Alain Claude Vaucher, Sharon Mitchell, Teodoro Laino, Javier Perez-Ramirez
Language models and protocol standardization guidelines for accelerating synthesis planning in heterogeneous catalysis. Nature communications 14 (1) (2023)
Alessandra Toniato, Jan P Unsleber, Alain Claude Vaucher, Thomas Weymuth, Daniel Probst, Teodoro Laino, Markus Reiher
Quantum chemical data generation as fill-in for reliability enhancement of machine-learning reaction and retrosynthesis planning. Digital discovery 2 (3) (2023)
Alessandra Toniato, Alain Claude Vaucher, Philippe Schwaller, Teodoro Laino
Enhancing diversity in language based models for single-step retrosynthesis. Digital discovery 2 (2) (2023)