<i>Apo2ph4</i>: A Versatile Workflow for the Generation of Receptor-based Pharmacophore Models for Virtual Screening
Jörg Heider, Jonas Kilian, Aleksandra Garifulina, Steffen Hering, Thierry Langer, Thomas Seidel
Abstract
for real-world drug design projects.
Topics & Concepts
PharmacophoreVirtual screeningWorkflowDrug discoveryLigand (biochemistry)Computer scienceComputational biologyCombinatorial chemistryChemistryReceptorStereochemistryDatabaseBiologyBiochemistryReceptor Mechanisms and SignalingComputational Drug Discovery MethodsChemical Synthesis and Analysis