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Events

19th EuroQSAR

Workshop Abstract

Monday, August 27th, 13.00

Presenter: Dr Katalin Nadassy, Advisory Scientist

Ligand Profiling Using Pharmacophores

Ligand profiling can provide valuable information on potential adverse drug reactions, off-target effects and drug repurposing.

We will present and demonstrate new pharmacophore-based ligand profiling tools available within Discovery Studio 3.5.

In collaboration with Prof. Didier Rognan, CNRS Strasborg, a library of pharmacophore models (PharmaDB), derived from over 7,000 protein-ligand complexes, is now available.

The workshop will demonstrate practical application of ligand profiling in the context of PharmaDB


 


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