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Identification and characterization of fragment binding sites for allosteric ligand design using the site identification by ligand competitive saturation hotspots approach (SILCS-Hotspots)

Alexander D. MacKerell, Sunhwan Jo, Sirish Kaushik Lakkaraju, Christoffer Lind, Wenbo Yu

2020Biochimica et Biophysica Acta (BBA) - General Subjects69 citationsDOIOpen Access PDF

Topics & Concepts

Allosteric regulationBinding siteComputational biologyLigand (biochemistry)Drug discoveryLigand efficiencyChemistryG protein-coupled receptorBiologyReceptorBiochemistryReceptor Mechanisms and SignalingComputational Drug Discovery MethodsEstrogen and related hormone effects
Identification and characterization of fragment binding sites for allosteric ligand design using the site identification by ligand competitive saturation hotspots approach (SILCS-Hotspots) | Litcius