10 March 2024>: Database Analysis
Potential of Gut Microbial Metabolites in Treating Osteoporosis and Obesity: A Network Pharmacology and Bioinformatics Approach
Md. Niaj Morshed 1ACEF* , Md. Rezaul Karim 12BE* , Reshmi Akter 1CDE , Safia Iqbal 1DF , Ramya Mathiyalagan 1CDF , Jong Chan Ahn 1BD , Deok Chun Yang 13CF , Joong Hyun Song 4CD , Se Chan Kang 1DFG* , Dong Uk Yang 15BFG*DOI: 10.12659/MSM.942899
Med Sci Monit 2024; 30:e942899
Figure 8 Molecular dynamic simulation of compound K and TP53 protein complex. (A) RMSD, (B) RMSF, (C) ROG, (D) SASA, (E) H-Bond, and (F) MM-GBSA. RMSD – root-mean-square deviation; RMSF – root-mean-square fluctuation; ROG – radius of gyration; SASA – solvent-accessible surface area; MM-GBSA – molecular biomechanics generalized Born surface area. Desmond v6.3 Program in Schrödinger 2023–3 under the Linux platform was used to perform molecular dynamic simulation.