Research Article
Computational Modeling of the Interaction of Silver Nanoparticles with the Lipid Layer of the Skin
Table 1
Interaction energies between the clusters of 1, 3, 5, and 6 atoms of silver, stearic acid, palmitic acid, and quercetin.
| System | (kcal/mol) |
| Stearic acid 1 Ag | −2.79 | Stearic acid cluster 3 Ag | −18.58 | Stearic acid cluster 5 Ag | −8.51 | Stearic acid cluster 6 Ag | −75.47 | Palmitic acid 1 Ag | −3.41 | Palmitic acid cluster 3 Ag | −18.65 | Palmitic acid cluster 5 Ag | −8.53 | Palmitic acid cluster 6 Ag | −75.43 | Quercetin 1 Ag | −0.81 | Quercetin cluster 3 Ag | −24.44 | Quercetin cluster 5 Ag | −12.53 | Quercetin cluster 6 Ag | −80.16 | Glucose 1 Ag | −26.50 |
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