I am new here so it may be a childish question, but I wanted to understand how the nodes communicate atom information and force calculations.To that end I started going through the source code (version 5.1.2 and 4.5.4) but I am losing track of the functions. If you could point out the functions which I should take a closer look at or explain the flow yourself, that would be a great help. Thanks in advance,Ameya -- Gromacs Users mailing list
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