An efficient and extensible format, library, and API for binary trajectory data from molecular simulations

Magnus Lundborg, Rossen Apostolov, Daniel Spångberg, Anders Gärdenäs, David van der Spoel, Erik Lindahl. An efficient and extensible format, library, and API for binary trajectory data from molecular simulations. Journal of Computational Chemistry, 35(3):260-269, 2014. [doi]

Abstract

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