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Molecular Modelling Studio
Alessandro Mazzanti
Computational chemistry
Conformational Analysis
Geometry optimization and conformational search of small molecule as drug candidate.
Docking
Docking of small molecules against protein target to binding pose and potency extimation, in drug discovery.
Molecular Dynamics
Molecular dynamics small molecules and biomolecules, for extimation of considerable biological informations and quantities, like accessible conformations.
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