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[Seminar] Molecular dynamics à la carte: from small molecules to drug discovery

When 03 Jun, 2019 from
03:00 pm to 04:30 pm
Where Room 2.13
Contact Name Cláudio M. Soares
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Title: Molecular dynamics à la carte: from small molecules to drug discovery

Speaker: Dr. Francesco Colizzi

Affiliation: Institute for Research in Biomedicine, Barcelona, Spain

Abstract: During the seminar I will present, in a very general way, some recent applications of molecular dynamics (MD) simulations to study the conformational "universe" of small molecules and to characterize ligand-protein binding for fragment-based drug discovery. The versatility of MD simulations and their complementarity with experiments will be highlighted.

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