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Interactive molecular dynamics in SAMSON: Docking example

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Published on Dec 10, 2008

This video demonstrates a typical docking situation in SAMSON, where the adaptive algorithm automatically focuses computational resources on the most relevant interactions in the docking site (in this case, the interactions are modeled using the CHARMm19 force field). This allows to precisely compute interactions on cheap desktop computers. © NANO-D - INRIA. http://nano-d.inrialpes.fr

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