Röcken, Sebastien

1. Predicting solvation free energies with an implicit solvent machine learning potential
   2024/05/31 by Sebastien Röcken, Röcken, Sebastien, Anton F. Burnet +3 · 6 citations
   Chemistry · Computer Science · Materials Science · #Chemical Physics (physics.chem-ph) #Computational Drug Discovery Methods #Computational Physics (physics.comp-ph) #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science #Various Chemistry Research Topics
2. Enhancing Machine Learning Potentials through Transfer Learning across Chemical Elements
   2025/02/19 by Sebastien Röcken, Röcken, Sebastien, Julija Zavadlav +1 · 3 citations
   Materials Science · #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci)