Computer-aided drug design

In silico methods offer added-value support for drug discovery programs, being a first class tool for drug-target interactions analysis.

AliX delivers a wide range of computational chemistry-based lead discovery services and support:

• Ligand-approaches : scaffold hopping, pharmacophore search, similarity search
• Structure-based approaches : docking, homology modelling
• Ligand and structure-based drug design
• Generation of chemically feasible virtual libraries