Protein structure models, biophysical data
and high-performance computing
for drug design
AIC2022 International School
Talk presentations
Principles and applications of ligand- and structure-based drug design – ML Barreca
Barreca_Principles and Applications of ligand-and structure-based drug designPrinciples of small molecules docking – A Spinello
Spinello_Principles_Small_Molecule_Docking
Biophysical studies of protein-ligand adducts – L Scietti
SciettiFragment-based drug design – M Sturlese
Sturlese_FragBasedDrugDesign_SturleseFitting ligands into MX/CryoEM electron density – R Nicholls
NicholsPreparing a CIF file for ligand molecules – BD Belviso
press_Belviso
Innovative small molecule degraders affecting protein folding – A Astolfi
AstolfiAdvanced MD-based methods for fragment-protein studies: Supervised Molecular Dynamics – M Sturlese
Sturlese_Advanced_MD_Based_methods_for_Fragment-protein_studies_Supervides_Molecular_DynamicsTES-1025: a case study for structural validation of protein-ligand interactions – M Cianci
2022-09-ACIS2022-TES-2
Registration
Registration deadline: 1st July 2022
(deadline extension 22th July)
Notification of acceptance: 7th July 2022 (25th July)
Payment: 9th July 2022 (27th July)