Abstract
The development of simulation techniques that can elucidate the function of biomolecularnanodevices is still in its infancy. In this paper we summarize our approach to theinvestigation of structural properties of biomolecular systems with stochastic optimizationmethods. We briefly review the stochastic tunnelling method and summarize applicationsin two important areas of biomolecular structure prediction: protein folding andprotein–ligand association.
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