Prediction of Essential Binding Domains for the Endocannabinoid N-Arachidonoylethanolamine (AEA) in the Brain Cannabinoid CB1 receptor
The paper predicts essential binding domains of AEA in the CB1 receptor using molecular dynamics simulations, identifying the hydrophobic channel and H2/H3 region as critical for AEA binding.
PLoS ONE · Jun 28, 2021Peer-reviewedNeuroscience