Research Article

The Underlying Molecular Mechanisms Involved in Traditional Chinese Medicine Smilax china L. for the Treatment of Pelvic Inflammatory Disease

Table 2

Time-averaged H-bond properties obtained from MD simulation of five complexes.

ProteinLigandH-bond (number)H-bond distance (average, Å)H-bond angle (average, °)Detected H-bonds

PTGS2Isorhamnetin2.52.9414.8818
MAPK1Moracin M4.02.8516.1519
LCN2Rutin2.82.8514.5945
TNFRutin2.22.9416.9325
MMP9Oxyresveratrol4.32.7814.7820