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A transferable coarse-grained model for diphenylalanine: how to represent an environment driven conformational transition

Koc University Digital Collections · Papers
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molecular-dynamicsphysics
One of the major challenges in the development of coarse grained (CG) simulation models that aim at biomolecular structure formation processes is the correct representation of an environment-driven conformational change, for example, a folding/unfolding event upon interaction with an interface or up
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