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Champ de force (chimie)

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Champ de force (chimie)

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Machine learning for metallurgy II. A neural-network potential for magnesium

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Modelling long-range interactions in multiscale simulations of ferromagnetic materials

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Machine Learning Force Fields and Coarse-Grained Variables in Molecular Dynamics: Application to Materials and Biological Systems

Machine Learning Force Fields and Coarse-Grained Variables in Molecular Dynamics: Application to Materials and Biological Systems

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Prediction of aqueous free energies of solvation using coupled QM and MM explicit solvent simulations

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