G protein-coupled receptors (GPCRs) are membrane proteins critical in cellular signaling,
making them important targets for therapeutics. The activation of GPCRs is central to their …

We present a hybrid computational methodology to predict multiple energetically accessible
conformations for G protein-coupled receptors (GPCRs) that might play a role in binding to …

G protein-coupled receptors (GPCRs) play a pivotal role in signal transduction and
represent attractive targets for drug development. Recent advances in structural biology …

Highlights•Molecular dynamics can be used to explore relevant conformational states of
GPCRs.•Analysis of water molecules in a GPCR binding site can guide lead optimization.• …

The structural plasticity of G protein coupled receptors (GPCRs) leads to a conformational
universe going from inactive to active receptor states with several intermediate states. Many …

G protein‐coupled receptors (GPCRs) are one of the largest classes of human membrane
proteins. The aptitude of GPCRs to assume multiple conformational states enables them to …

G protein–coupled receptors (GPCRs) are implicated in nearly all physiological processes in
the human body and represent an important drug targeting class. The genes encoding the …

Background: Despite the large amount of experimental data accumulated in the past decade
on G-protein-coupled receptor (GPCR) structure and function, understanding of the …

G protein-coupled receptors (GPCRs) belong to a large superfamily of membrane proteins
and they mediate many physiological and pathological processes in cell signaling. GPCRs …

The determination of G protein-coupled receptor (GPCR) structures at atomic resolution has
improved understanding of cellular signaling and will accelerate the development of new …