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In addition, dipole moments of the chemicals were calculated using the Millsian 2.1 Beta (Millsian, Inc., Cranbury, NJ, USA).
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For single geomembrane liners, mass transport of inorganic chemicals is calculated from the leakage rate from holes for an assumed frequency of hole occurrence.
The aggregate activity of each of 309 chemicals was calculated across all assayed NR with the results visualized as the heatmap in Figure 1(b).
The cell viability of samples at each concentration of the drugs or chemicals was calculated by dividing the optical density of samples with that of control.
Dietary intake of these chemicals was calculated for an average American.
Dioxin toxic equivalents for the two groups of chemicals are calculated and compared.
The amount of each studied chemical was calculated with a calibration curve, which was obtained by using standard solutions of the same compound at various concentrations.
The dose of each chemical was calculated daily according to body weight of each rat before dosing.
Machine and chemical costs were calculated by using current list prices of machinery and actual costs of chemicals.
H chemical shifts were referenced to DSS at 0 ppm, and C and N chemical shifts were calculated from the H frequency.
Various chemical descriptors were calculated by E-Dragon.
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