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Publications by Andrea Cavalli

Intriguing Role of Water in Protein-Ligand Binding Studied by Neutron Crystallography on Trypsin Complexes

Nature Communications
AstronomyGeneticsMolecular BiologyBiochemistryChemistryPhysics
2018English

Combining Galantamine and Memantine in Multitargeted, New Chemical Entities Potentially Useful in Alzheimer’s Disease

Journal of Medicinal Chemistry
Drug DiscoveryMolecular Medicine
2012English

Molecular Simulations to Unravel the Allosteric Interplay Between the SH2 Domain and A-Loop Plasticity in Protein Kinases

Biophysical Journal
Biophysics
2017English

Multi-Target Dopamine D3 Receptor Modulators: Actionable Knowledge for Drug Design From Molecular Dynamics and Machine Learning

European Journal of Medicinal Chemistry
MedicineOrganic ChemistryDrug DiscoveryPharmacology
2020English

Calpain-1 Regulates Bax and Subsequent Smac-Dependent Caspase-3 Activation in Neutrophil Apoptosis

Journal of Biological Chemistry
BiochemistryCell BiologyMolecular Biology
2003English

Comparison of Sequence-Based and Structure-Based Energy Functions for the Reversible Folding of a Peptide

Biophysical Journal
Biophysics
2005English

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