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Comparison of the binding energies of approved mpox drugs and phytochemicals through molecular docking, molecular dynamics simulation, and ADMET studies: An in silico approach

R. Mohapatra, A. Mahal, Azaj Ansari, Manjeet Kumar, Jyoti Prakash Guru, Ashish K. Sarangi, A. Abdou, Snehasis Mishra, M. Aljeldah, B. Alshehail, Mohammed Alissa, Mohammed A. Garout, A. Alsayyah, Ahmad A. Alshehri, A. Saif, Abdulaziz Alqahtani, Fahd A. Alshehri, Aref A. Alamri, A. Rabaan

2023.9.1Journal of Biosafety and Biosecurity

DOI: 10.1016/j.jobb.2023.09.001

Abstract

Abstract is not available.

Citation format

MOHAPATRA, R., et al. Comparison of the binding energies of approved mpox drugs and phytochemicals through molecular docking, molecular dynamics simulation, and ADMET studies: An in silico approach. Journal of Biosafety and Biosecurity, 2023.