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20242026
most citedGenerator of Neural Network Potential for Molecular Dynamics: Constructing Robust and Accurate Potentials with Active Learning for Nanosecond-scale Simulations

17 citations · 20 across the 5 of their papers we have counts for

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physics.chem-ph2024★ 3 cited

Transferability of the chemical bond-based machine learning model for dipole moment: the GHz to THz dielectric properties of liquid propylene glycol and polypropylene glycol

Tomohito Amano, Tamio Yamazaki, Naoki Matsumura +2

We conducted a first-principles study of the dielectric properties of liquid propylene glycol (PG) and polypropylene glycol (PPG) using a recently developed chemical bond-based mac…