Justin Lemkul
Department of Biochemistry, Virginia Tech
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This example will guide a new user through the process of setting up a simulation system containing a protein (lysozyme) in a box of water, with ions. Each step will contain an explanation of input and output, using typical settings for general use. This tutorial assumes you are using a GROMACS version in the 4.5.x or 4.6.x series. Tutorials Home |
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