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Attribution
AceFF: A State-of-the-Art Machine Learning Potential for Small Molecules
arXiv 2026
mdCATH: A Large-Scale MD Dataset for Data-Driven Computational Biophysics
arXiv 2024
from 2 papers
Gianni de Fabritiis
Francesc Sabanés Zariquiey
Stefan Doerr
Stephen E. Farr
Toni Giorgino