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. 2024 May 4;29(9):2140. doi: 10.3390/molecules29092140
A atropine
BAR Bennett Acceptance Ratio
BChE butyrylcholinesterase
BTC butyrylthiocholine
CAC catalytic active center
CES carboxylesterase
ChE cholinesterase
FEP free energy perturbation
MD molecular dynamics
OP organophosphate
PAS peripheral anionic site