The synapse is a piece of information transfer machinery replacing the electrical conduction
of nerve impulses at the end of the neuron. Like many biological mechanisms, its functioning …

Secondary pharmacology screening of investigational small-molecule drugs for potentially
adverse off-target activities has become standard practice in pharmaceutical research and …

AlphaFold2 (AF2) models have had wide impact, but they have had mixed success in
retrospective ligand recognition. We prospectively docked large libraries against unrefined …

Abstract AlphaFold2 (AF2) and RosettaFold have greatly expanded the number of structures
available for structure-based ligand discovery, even though retrospective studies have cast …

Classical psychedelics such as psilocybin, lysergic acid diethylamide (LSD), and N, N-
dimethyltryptamine (DMT) are showing promising results in clinical trials for a range of …

The introduction of arylmethyl substituents on the amine nitrogen atom of phenethylamines
and tryptamines often results in profound increases in their affinity and functional activity at 5 …

Schizophrenia (SZ) is a multifactorial disorder characterized by volume reduction in gray
and white matter, oxidative stress, neuroinflammation, altered neurotransmission, as well as …

The 5HT2A receptor (5HT2AR) is a G protein-coupled receptor that drives many neuronal
functions and is one of the primary targets for psychedelic drugs, which have recently shown …

Psychedelic-assisted psychotherapy has over the last decade emerged as a promising
treatment strategy for mental health disease, and the therapeutic potential in classical …