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Subject name: Molecular Modelling - Back

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Molecular modelling course teaches how to elucidate the structure and function of a biopolymers using related modelling tools and algorithms of bioinformatics. The targeted areas are in protein structure modelling,force field, energy minimization, and molecular dynamics simulations of complexsystems (protein-ligand, membrane-protein …), pH-and temperature dependent (simulated annealing) simulations, structure-based drug design, molecular docking, computational drug screening, cheminformatics. Students will learn the principles and applications of each of algorithms and programs used in structural modelling.