Supporting Information
Table S1: Adsorption free energies for each SCA on Al surfaces; Figure S1: Water density profiles for aluminum slabs: (a) Al(100), (b) Al(110), (c) Al(111), Figure S2: Influence of the NP size on the adsorption energies; Figure S3: Milk molecules ranking based on mass abundance in the corona, Figure S4: Example of AlNP size-dependent interaction of ALAC: (a) 2 nm, (b) 5 nm, (c) 10 nm, (d) 20 nm, (e) 40 nm, (f) 50 nm, (g) 80 nm, (d) 100 nm; Figures S5–S10: Comparison of interaction of AS1C, AS2C,β-casein, ALAC, BLAC, BSA, with different Al fcc surfaces: (a) Al(100), (b) Al(110), (c) Al(111); Table S2: Description of 820 milk proteins interaction with Al (100, 110, 111) based on the lowest energy values of the adsorption heatmaps.
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| Supporting Information File 2: 820-Milk-protein-table. | ||
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