/tools/FlexAID

FlexAID

NRGlab/FlexAID

17 stars14 forksC++WebsiteAdded February 4, 2026
summary

FlexAID is a software tool that facilitates flexible docking of ligands to protein targets, allowing for the optimization of binding conformations. It utilizes genetic algorithms for ligand optimization and is relevant for molecular docking studies in drug discovery.

description

Flexible Artificial Intelligence Docking

topics

dockingmolecular-dockingprotein-ligand-dockingligand-screeningprotein-ligand-binding-conformationprotein-ligand-interactionsprotein-ligand-interfaces

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