An average PLP score per atom of many protein-ligand complexes leads to the following heuristic, Nirmatrelvir has 35 heavy atoms, and in the 1 st binding mode seen in Figure (a,b), scores ≥ 66. The atomic score distributions are generated from the output gold.mol2 files. Color-coding is used to illustrate in the molecule structure the amount of interaction from individual atoms, Figure coming from the more detailed atomic score distributions in Figure . The -bi,-tri, high refer to bi-modal, trimodal, high interaction or very high interaction (anomalously so); the atom color is the larger peak in states, and the second peak descriptor, e.g., bi-, is smaller. A plus or minus means the peak contains the color change point, and the +(-) means the smaller side is in that color. These distributions and color coding of the molecule give a tremendous amount of binding information for a set of states such as the highest binding mode.