Computational studies of transport in ion channels using metadynamics.

Molecular dynamics simulations have played a fundamental role in numerous fields of science by providing insights into the structure and dynamics of complex systems at the atomistic level. However, exhaustive sampling by standard molecular dynamics is in most cases computationally prohibitive, and t...

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Main Authors: Furini, S, Domene, C
格式: Journal article
語言:English
出版: Elsevier 2016