Learning a Reactive Potential for Silica-Water Through Uncertainty Attribution
- Swagata Roy
- Johannes Duerholt
- et al.
- 2022
- MRS Fall Meeting 2022
Publications
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22 results for Federico Zipoli
Enzeptional: enzyme optimization via a generative language modeling-based evolutionary algorithm
- 2023
- MRS Fall Meeting 2023
Using Foundation Models to Promote Digitization and Reproducibility in Scientific Experimentation
- Amol Thakkar
- Andrea Giovannini
- et al.
- 2023
- NeurIPS 2023
Learning the Language of NMR: Structure Elucidation from NMR spectra using Transformer Models
- 2023
- NeurIPS 2023
Unveiling the Secrets of 1H-NMR Spectroscopy: A Novel Approach Utilizing Attention Mechanisms
- Oliver Schilter
- Marvin Alberts
- et al.
- 2023
- NeurIPS 2023
Growing strings in a chemical reaction space for searching retrosynthesis pathways
- 2024
- npj Computational Materials
A new era of collaborative experimentation enabled by multi-cloud and AI foundation models
- Patrick Ruch
- Alain Vaucher
- et al.
- 2023
- Future Labs Live 2023
Multimodal foundation models for more reproducible scientific experimentation and data capture
- 2024
- Future Labs Live 2024
Learning from literature-extracted synthesis actions for organic synthesis
- Alain Vaucher
- Philippe Schwaller
- et al.
- 2022
- AMLD EPFL 2022
Prediction of Phase Diagrams and Associated Phase Structural Properties
- Federico Zipoli
- Victor Viterbo
- et al.
- 2022
- MRS-J 2022