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A good agreement between measured and calculated values was found.
A comparative evaluation between experimental results and COSMO-RS calculated values was performed.
The rmsd between the measured and calculated values was 0.49 Hz indicating a good agreement between dihedral angles in RDC-restrained MD structures and J-based dihedral angles.
The comparison of the testing results and calculated values was shown in Table 4.
And the agreement between the experimental data and the calculated values was relatively good using isocratic separation for eight isoflavones, but the retention time is very long.
The absolute average deviation and maximum deviation of the pressure from the calculated values was 0.79% and 2.67% for R1234ze(E) + PEC6 system, respectively.
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Such calculated values are in good agreement with the experimental Tpv values.
Finally, analytically calculated values are confronted to experimental values, and show a very good agreement.
The variations between the measured and calculated values were less than 10%.
The validity of this procedure is checked and agreement with the explicitly calculated values is found.
Conclusions: Despite good correlations, the eGFR calculated values were not good measures of actual renal function.
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CEO of Professional Science Editing for Scientists @ prosciediting.com