The Pawsey Supercomputing Centre

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Large scale molecular dynamics simulations of macrobiomolecular complexes

By Daniel Bartels • February 18th, 2015
Large scale molecular dynamics simulations of macrobiomolecular complexes

This project aims to use large scale computer simulation methods to describe the behaviour of a range of molecules of biological interest, such as cell membranes, polymeric nanoparticles and protein complexes. These biomolecular systems have importance for our understanding of (1) cell damage during cryopreservation and dehydration, (2) the delivery of drug molecules to targetedmore…