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Delineating binding potential, stability of Sulforaphane-N-acetyl-cysteine in the active site of histone deacetylase 2 and testing its cytotoxicity against distinct cancer lines through stringent molecular dynamics, DFT and cell-based assays.
Ganai SA, Srinivasan P, Rajamanikandan S, Shah BA, Mohan S, Gani M, Padder BA, Qadri RA, Bhat MA, Baba ZA, Yatoo MA. Ganai SA, et al. Among authors: gani m. Chem Biol Drug Des. 2021 Sep;98(3):363-376. doi: 10.1111/cbdd.13854. Epub 2021 Jun 19. Chem Biol Drug Des. 2021. PMID: 33966346