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Attribution
AceFF: A State-of-the-Art Machine Learning Potential for Small Molecules
arXiv 2026
QuantumBind-RBFE: Accurate Relative Binding Free Energy Calculations Using Neural Network Potentials
arXiv 2025
from 2 papers
Francesc Sabanés Zariquiey
Gianni de Fabritiis
Stefan Doerr
Antonio Mirarchi