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Application of Mixed-Solvent Molecular Dynamics Simulations for Prediction of Allosteric Sites on G Protein–Coupled Receptors

Wallace Chan, Heather A. Carlson, John R. Traynor

2023Molecular Pharmacology11 citationsDOIOpen Access PDF

Topics & Concepts

Allosteric regulationDruggabilityG protein-coupled receptorDrug discoveryComputational biologyReceptorChemistryAllosteric modulatorBiologyBiochemistryGeneReceptor Mechanisms and SignalingNeuropeptides and Animal PhysiologyComputational Drug Discovery Methods
Application of Mixed-Solvent Molecular Dynamics Simulations for Prediction of Allosteric Sites on G Protein–Coupled Receptors | Litcius