ML Anthology
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Gil, Victor Sabanza
2 publications
NeurIPSW
2024
Best Practices for Multi-Fidelity Bayesian Optimization in Materials and Molecular Research
Victor Sabanza Gil
,
Riccardo Barbano
,
Daniel Pacheco Gutiérrez
,
Jeremy Scott Luterbacher
,
José Miguel Hernández-Lobato
,
Philippe Schwaller
,
Loïc Roch
NeurIPSW
2023
Holistic Chemical Evaluation Reveals Pitfalls in Reaction Prediction Models
Victor Sabanza Gil
,
Andres M Bran
,
Malte Franke
,
Rémi Schlama
,
Jeremy S. Luterbacher
,
Philippe Schwaller