and isomerically, The increased ligand interaction to the Mpro site by the highest scores of Mpro and 74:19 is PLP 20.43, 29%. The highest pose to CYP 3A4 increases by 9.83, 12%. In addition, the interaction differences between the 2 proteins goes from 13.76 to 3.16; this is much more in favor of Mpro than to CYP 3A4 energetically. The point at 94.27 is an outlier in the distribution of scores and if a CYP 3A4 90 were used to compare the difference of scores from CYP 3A4 to Mpro would be negative. In addition to docking score uncertainty, modeling the molecule is comparable in interaction to Mpro as to CYP 3A4, unlike Nirmatrelvir with a separation of 13.76.