03 August 2025 : Database Analysis
Periodontal Implications of Porphyromonas gingivalis-Derived Metabolites in Host Antioxidant and Anti-Inflammatory Mechanisms: A Computational Analysis
Abdullah Alqarni
ABEF 1, Jagadish Hosmani ABEF 1, Saeed Abdulrahman Alassiri BCEF 1, Ali Fahad Abdullah Al Qahtani CDE 2, Mohammad Al Magbol EFG 2, Hussain Almubarak FG 1, Shankargouda Patil AEFG 3,4*
DOI: 10.12659/MSM.949167
Med Sci Monit 2025; 31:e949167
Figure 7 (A) Rg versus time graph of the apo PON1(black) and PON1-C38H70O10P+ (red) derived from the MD simulations (GROMACS, 2021). (B) Analysis of SASA trajectories presenting time versus area of apo PON1(black) and PON1-C38H70O10P+ (red) (GROMACS, 2021). (C) HB trajectories analysis presenting time versus number of hydrogen bonds formed within the apo PON1(black) and PON1-C38H70O10P+ (red) (GROMACS, 2021).