Welcome to the GQC! We currently have three main areas of work:

Materials

• Small transition metal clusters.
• Adsorption of small molecules on metal surfaces.licas

Biological Systems

• Prediction of structural and spectroscopic properties.
• Virtual structural screening.
• Calculation of ligand/receptor binding energies.

Software Development

• Flexo - Conformational search of small molecules gqc.quimica.unlp.edu.ar/flexo.
• NaturAr - Natural products from Argentina naturar.quimica.unlp.edu.ar.
• Target Fisher - Target prediction gqc.quimica.unlp.edu.ar/targetfisher.