Publications

9 results at Machine Learning: Science and Tech.

Multi-View Mixture-of-Experts for predicting molecular properties using SMILES, SELFIES, and graph-based representations
- - Eduardo Almeida Soares
  - Victor Yukio Shirasuna
  - et al.
- 2025
- Machine Learning: Science and Tech.
Completion of partial chemical equations
- - Federico Zipoli
  - Zeineb Ayadi
  - et al.
- 2024
- Machine Learning: Science and Tech.
Unravelling physics beyond the standard model with classical and quantum anomaly detection
- - Julian Schuhmacher
  - Laura Boggia
  - et al.
- 2023
- Machine Learning: Science and Tech.
Standardizing chemical compounds with language models
- - Miruna T Cretu
  - Alessandra Toniato
  - et al.
- 2023
- Machine Learning: Science and Tech.
Quantum machine learning framework for virtual screening in drug discovery: a prospective quantum advantage
- - Stefano Mensa
  - Emre Sahin
  - et al.
- 2023
- Machine Learning: Science and Tech.
Quantum neural networks force fields generation
- - Oriel Kiss
  - Francesco Tacchino
  - et al.
- 2022
- Machine Learning: Science and Tech.
Phases of learning dynamics in artificial neural networks in the absence or presence of mislabeled data
- - Yu Feng
  - Yuhai Tu
- 2021
- Machine Learning: Science and Tech.
Prediction of chemical reaction yields using deep learning
- - Philippe Schwaller
  - Alain C. Vaucher
  - et al.
- 2021
- Machine Learning: Science and Tech.
Data-driven molecular design for discovery and synthesis of novel ligands: A case study on SARS-CoV-2
- - Jannis Born
  - Matteo Manica
  - et al.
- 2021
- Machine Learning: Science and Tech.