Potential of Gut Microbial Metabolites in Treating Osteoporosis and Obesity: A Network Pharmacology and Bioinformatics Approach

Md. Niaj Morshed; Md. Rezaul Karim; Reshmi Akter; Safia Iqbal; Ramya Mathiyalagan; Jong Chan Ahn; Deok Chun Yang; Joong Hyun Song; Se Chan Kang; Dong Uk Yang

doi:10.12659/MSM.942899

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

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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.

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Potential of Gut Microbial Metabolites in Treating Osteoporosis and Obesity: A Network Pharmacology and Bioinformatics Approach

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